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4,6(1H,5H)-Pyrimidinedione,dihydro-5-[(2-hydroxyphenyl)methylene]-1-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]amino]-3-phenyl-2-thioxo- structure
Fine Chemical

4,6(1H,5H)-Pyrimidinedione,dihydro-5-[(2-hydroxyphenyl)methylene]-1-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]amino]-3-phenyl-2-thioxo-

TL;DR: 4,6(1H,5H)-Pyrimidinedione,dihydro-5-[(2-hydroxyphenyl)methylene]-1-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]amino]-3-phenyl-2-thioxo- (CAS 141177-60-8) is a chemical compound with molecular formula C31H22N4O4S2 and molecular weight 578.1083 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

5-[(2-hydroxyphenyl)methylidene]-1-[(2-oxo-2-phenothiazin-10-ylethyl)amino]-3-phenyl-2-sulfanylidene-1,3-diazinane-4,6-dione

Also Known As: 4,6(1H,5H)-Pyrimidinedione,dihydro-5-[(2-hydroxyphenyl)methylene]-1-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]amino]-3-phenyl-2-thioxo-, 10H-Phenothiazine, 10-(((tetrahydro-5-((2-hydroxyphenyl)methylene)-4,6-dioxo-3-phenyl-2-thioxo-1(2H)-pyrimidinyl)amino)acetyl)-

CAS Number
141177-60-8
Molecular Formula
C31H22N4O4S2
Molecular Weight
578.1083 g/mol
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Technical Specifications

Molecular FormulaC31H22N4O4S2
Molecular Weight578.1083 g/mol
XLogP5.7
Topological Polar Surface Area (TPSA)151.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors7
Rotatable Bonds5
Exact Mass578.1083 Da
Heavy Atoms41
Complexity1040.0
SMILESC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=CC=C3O)C(=O)N(C2=S)NCC(=O)N4C5=CC=CC=C5SC6=CC=CC=C64
InChIKeyQGUIBHBPYYSHQM-UHFFFAOYSA-N

Chemical Property Profile of 4,6(1H,5H)-Pyrimidinedione,dihydro-5-[(2-hydroxyphenyl)methylene]-1-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]amino]-3-phenyl-2-thioxo-

XLogP
5.7
TPSA (Topological Polar Surface Area)
151.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
7
Rotatable Bonds
5
Heavy Atoms
41
Complexity
1040.0
Exact Mass
578.1083
Monoisotopic Mass
578.1083
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 4,6(1H,5H)-Pyrimidinedione,dihydro-5-[(2-hydroxyphenyl)methylene]-1-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]amino]-3-phenyl-2-thioxo-

The XLogP value of 5.7 indicates that 4,6(1H,5H)-Pyrimidinedione,dihydro-5-[(2-hydroxyphenyl)methylene]-1-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]amino]-3-phenyl-2-thioxo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 151.0 Ų indicates high polarity, suggesting 4,6(1H,5H)-Pyrimidinedione,dihydro-5-[(2-hydroxyphenyl)methylene]-1-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]amino]-3-phenyl-2-thioxo- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4,6(1H,5H)-Pyrimidinedione,dihydro-5-[(2-hydroxyphenyl)methylene]-1-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]amino]-3-phenyl-2-thioxo- has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of 4,6(1H,5H)-Pyrimidinedione,dihydro-5-[(2-hydroxyphenyl)methylene]-1-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]amino]-3-phenyl-2-thioxo-?

The CAS number of 4,6(1H,5H)-Pyrimidinedione,dihydro-5-[(2-hydroxyphenyl)methylene]-1-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]amino]-3-phenyl-2-thioxo- is 141177-60-8.

What is the molecular formula of 4,6(1H,5H)-Pyrimidinedione,dihydro-5-[(2-hydroxyphenyl)methylene]-1-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]amino]-3-phenyl-2-thioxo-?

The molecular formula of 4,6(1H,5H)-Pyrimidinedione,dihydro-5-[(2-hydroxyphenyl)methylene]-1-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]amino]-3-phenyl-2-thioxo- is C31H22N4O4S2.

What is the molecular weight of 4,6(1H,5H)-Pyrimidinedione,dihydro-5-[(2-hydroxyphenyl)methylene]-1-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]amino]-3-phenyl-2-thioxo-?

The molecular weight of 4,6(1H,5H)-Pyrimidinedione,dihydro-5-[(2-hydroxyphenyl)methylene]-1-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]amino]-3-phenyl-2-thioxo- is 578.1083 g/mol.

Where can I buy 4,6(1H,5H)-Pyrimidinedione,dihydro-5-[(2-hydroxyphenyl)methylene]-1-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]amino]-3-phenyl-2-thioxo-?

You can request a quote for 4,6(1H,5H)-Pyrimidinedione,dihydro-5-[(2-hydroxyphenyl)methylene]-1-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]amino]-3-phenyl-2-thioxo- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 4,6(1H,5H)-Pyrimidinedione,dihydro-5-[(2-hydroxyphenyl)methylene]-1-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]amino]-3-phenyl-2-thioxo-?

Yes, CoreyChem provides custom synthesis services for 4,6(1H,5H)-Pyrimidinedione,dihydro-5-[(2-hydroxyphenyl)methylene]-1-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]amino]-3-phenyl-2-thioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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