AB00685412-01
TL;DR: AB00685412-01 (CAS 440324-07-2) is a chemical compound with molecular formula C23H17ClN4O2S2 and molecular weight 480.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(7-chloro-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-one
Also Known As: AB00685412-01, F0916-6695, 2-[({7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl}methyl)sulfanyl]-3-[(4-methylphenyl)methyl]-3H,4H-thieno[3,2-d]pyrimidin-4-one, 2-(((7-chloro-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl)thio)-3-(4-methylbenzyl)thieno[3,2-d]pyrimidin-4(3H)-one, 2-[(7-chloro-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-one
| Molecular Formula | C23H17ClN4O2S2 |
|---|---|
| Molecular Weight | 480.05 g/mol |
| LogP | 4.76832 |
| Topological Polar Surface Area | 69.26 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 480.04816 |
| Heavy Atoms | 32 |
| Complexity | 1571.841 |
Chemical Identifiers
| CAS Number | 440324-07-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C(=O)C3=C(C=CS3)N=C2SCC4=CC(=O)N5C=C(C=CC5=N4)Cl |
Product Overview
AB00685412-01 (CAS 440324-07-2), with molecular formula C23H17ClN4O2S2 and molecular weight 480.05 g/mol. IUPAC: 2-[(7-chloro-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-3-[(4-methylphenyl)methyl]thieno[3,2-d]pyrimidin-4-one.
Chemical Property Profile of AB00685412-01
Property Insights of AB00685412-01
The XLogP value of 4.76832 indicates that AB00685412-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.26 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00685412-01. Following Lipinski's Rule of Five, AB00685412-01 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00685412-01?
The CAS number of AB00685412-01 is 440324-07-2.
What is the molecular formula of AB00685412-01?
The molecular formula of AB00685412-01 is C23H17ClN4O2S2.
What is the molecular weight of AB00685412-01?
The molecular weight of AB00685412-01 is 480.05 g/mol.
Where can I buy AB00685412-01?
You can request a quote for AB00685412-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00685412-01?
Yes, KEHONG BIO provides custom synthesis services for AB00685412-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.