AB00668742-01
TL;DR: AB00668742-01 (CAS 686772-23-6) is a chemical compound with molecular formula C25H21N3O3S2 and molecular weight 475.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-(2-methoxyphenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]-N-naphthalen-1-ylacetamide
Also Known As: AB00668742-01, F0579-0253, 2-{[3-(2-methoxyphenyl)-4-oxo-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide, 2-((3-(2-methoxyphenyl)-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)thio)-N-(naphthalen-1-yl)acetamide, 2-[[3-(2-methoxyphenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]-N-naphthalen-1-ylacetamide
| Molecular Formula | C25H21N3O3S2 |
|---|---|
| Molecular Weight | 475.10 g/mol |
| LogP | 4.7733 |
| Topological Polar Surface Area | 73.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 475.10245 |
| Heavy Atoms | 33 |
| Complexity | 1412.6842 |
Chemical Identifiers
| CAS Number | 686772-23-6 |
|---|---|
| SMILES | COC1=CC=CC=C1N2C(=O)C3=C(CCS3)N=C2SCC(=O)NC4=CC=CC5=CC=CC=C54 |
Product Overview
AB00668742-01 (CAS 686772-23-6), with molecular formula C25H21N3O3S2 and molecular weight 475.10 g/mol. IUPAC: 2-[[3-(2-methoxyphenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]-N-naphthalen-1-ylacetamide.
Chemical Property Profile of AB00668742-01
Property Insights of AB00668742-01
The XLogP value of 4.7733 indicates that AB00668742-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.22 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00668742-01. Following Lipinski's Rule of Five, AB00668742-01 has 1 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 AB00668742-01?
The CAS number of AB00668742-01 is 686772-23-6.
What is the molecular formula of AB00668742-01?
The molecular formula of AB00668742-01 is C25H21N3O3S2.
What is the molecular weight of AB00668742-01?
The molecular weight of AB00668742-01 is 475.10 g/mol.
Where can I buy AB00668742-01?
You can request a quote for AB00668742-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00668742-01?
Yes, KEHONG BIO provides custom synthesis services for AB00668742-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.