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C29H39N3O4S structure
Fine Chemical

C29H39N3O4S

TL;DR: C29H39N3O4S (CAS 1024595-01-4) is a chemical compound with molecular formula C29H39N3O4S and molecular weight 525.2661 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[1-(4-ethoxyphenyl)-3-heptyl-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-propoxyphenyl)acetamide

Also Known As: 2-[1-(4-ethoxyphenyl)-3-heptyl-5-oxo-2-thioxoimidazolidin-4-yl]-N-(4-propoxyphenyl)acetamide, 2-(1-(4-ethoxyphenyl)-3-heptyl-5-oxo-2-thioxoimidazolidin-4-yl)-N-(4-propoxyphenyl)acetamide, 2-[1-(4-ethoxyphenyl)-3-heptyl-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-propoxyphenyl)acetamide, C29H39N3O4S

CAS Number
1024595-01-4
Molecular Formula
C29H39N3O4S
Molecular Weight
525.2661 g/mol
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Technical Specifications

Molecular FormulaC29H39N3O4S
Molecular Weight525.2661 g/mol
XLogP6.4
Topological Polar Surface Area (TPSA)103.0 Ų
Hydrogen Bond Donors1
Hydrogen Bond Acceptors5
Rotatable Bonds15
Exact Mass525.2661 Da
Heavy Atoms37
Complexity720.0
SMILESCCCCCCCN1C(C(=O)N(C1=S)C2=CC=C(C=C2)OCC)CC(=O)NC3=CC=C(C=C3)OCCC
InChIKeyKHMKCBPFZMDBEK-UHFFFAOYSA-N

Chemical Property Profile of C29H39N3O4S

XLogP
6.4
TPSA (Topological Polar Surface Area)
103.0
Hydrogen Bond Donors
1
Hydrogen Bond Acceptors
5
Rotatable Bonds
15
Heavy Atoms
37
Complexity
720.0
Exact Mass
525.2661
Monoisotopic Mass
525.2661
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 C29H39N3O4S

The XLogP value of 6.4 indicates that C29H39N3O4S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for C29H39N3O4S. Following Lipinski's Rule of Five, C29H39N3O4S has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of C29H39N3O4S?

The CAS number of C29H39N3O4S is 1024595-01-4.

What is the molecular formula of C29H39N3O4S?

The molecular formula of C29H39N3O4S is C29H39N3O4S.

What is the molecular weight of C29H39N3O4S?

The molecular weight of C29H39N3O4S is 525.2661 g/mol.

Where can I buy C29H39N3O4S?

You can request a quote for C29H39N3O4S directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for C29H39N3O4S?

Yes, CoreyChem provides custom synthesis services for C29H39N3O4S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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