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5,9,10-trimethyl-8H-thieno[2',3':4,5]pyrimido[2,1-a]phthalazin-8-one structure
Fine Chemical

5,9,10-trimethyl-8H-thieno[2',3':4,5]pyrimido[2,1-a]phthalazin-8-one

TL;DR: 5,9,10-trimethyl-8H-thieno[2',3':4,5]pyrimido[2,1-a]phthalazin-8-one (CAS 134478-38-9) is a chemical compound with molecular formula C16H13N3OS and molecular weight 295.07794 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

8,13,14-trimethyl-15-thia-9,10,17-triazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(17),2,4,6,8,12(16),13-heptaen-11-one

Also Known As: 5,9,10-trimethyl-8H-thieno[2',3':4,5]pyrimido[2,1-a]phthalazin-8-one, AF-399/41083808, F1143-1288, 8,13,14-trimethyl-15-thia-9,10,17-triazatetracyclo[8.7.0.0^{2,7}.0^{12,16}]heptadeca-1(17),2(7),3,5,8,12(16),13-heptaen-11-one, 8,13,14-trimethyl-15-thia-9,10,17-triazatetracyclo[8.7.0.02,7.012,16]heptadeca-1(17),2,4,6,8,12(16),13-heptaen-11-one

CAS Number
134478-38-9
Molecular Formula
C16H13N3OS
Molecular Weight
295.07794 g/mol
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Technical Specifications

Molecular FormulaC16H13N3OS
Molecular Weight295.07794 g/mol
XLogP3.1
Topological Polar Surface Area (TPSA)73.3 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors4
Rotatable Bonds0
Exact Mass295.07794 Da
Heavy Atoms21
Complexity544.0
SMILESCC1=C(SC2=C1C(=O)N3C(=N2)C4=CC=CC=C4C(=N3)C)C
InChIKeyMZPDWRLQUCYIJU-UHFFFAOYSA-N

Chemical Property Profile of 5,9,10-trimethyl-8H-thieno[2',3':4,5]pyrimido[2,1-a]phthalazin-8-one

XLogP
3.1
TPSA (Topological Polar Surface Area)
73.3
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
0
Heavy Atoms
21
Complexity
544.0
Exact Mass
295.07794
Monoisotopic Mass
295.07794
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 5,9,10-trimethyl-8H-thieno[2',3':4,5]pyrimido[2,1-a]phthalazin-8-one

The XLogP value of 3.1 indicates that 5,9,10-trimethyl-8H-thieno[2',3':4,5]pyrimido[2,1-a]phthalazin-8-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 5,9,10-trimethyl-8H-thieno[2',3':4,5]pyrimido[2,1-a]phthalazin-8-one. Following Lipinski's Rule of Five, 5,9,10-trimethyl-8H-thieno[2',3':4,5]pyrimido[2,1-a]phthalazin-8-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 5,9,10-trimethyl-8H-thieno[2',3':4,5]pyrimido[2,1-a]phthalazin-8-one?

The CAS number of 5,9,10-trimethyl-8H-thieno[2',3':4,5]pyrimido[2,1-a]phthalazin-8-one is 134478-38-9.

What is the molecular formula of 5,9,10-trimethyl-8H-thieno[2',3':4,5]pyrimido[2,1-a]phthalazin-8-one?

The molecular formula of 5,9,10-trimethyl-8H-thieno[2',3':4,5]pyrimido[2,1-a]phthalazin-8-one is C16H13N3OS.

What is the molecular weight of 5,9,10-trimethyl-8H-thieno[2',3':4,5]pyrimido[2,1-a]phthalazin-8-one?

The molecular weight of 5,9,10-trimethyl-8H-thieno[2',3':4,5]pyrimido[2,1-a]phthalazin-8-one is 295.07794 g/mol.

Where can I buy 5,9,10-trimethyl-8H-thieno[2',3':4,5]pyrimido[2,1-a]phthalazin-8-one?

You can request a quote for 5,9,10-trimethyl-8H-thieno[2',3':4,5]pyrimido[2,1-a]phthalazin-8-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 5,9,10-trimethyl-8H-thieno[2',3':4,5]pyrimido[2,1-a]phthalazin-8-one?

Yes, CoreyChem provides custom synthesis services for 5,9,10-trimethyl-8H-thieno[2',3':4,5]pyrimido[2,1-a]phthalazin-8-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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