AB00668723-01
TL;DR: AB00668723-01 (CAS 686771-52-8) is a chemical compound with molecular formula C15H15N3O2S2 and molecular weight 333.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-(4-methylphenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide
Also Known As: AB00668723-01, F0579-0148, 2-{[3-(4-methylphenyl)-4-oxo-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide, 2-((4-oxo-3-(p-tolyl)-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl)thio)acetamide, 2-[[3-(4-methylphenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide
| Molecular Formula | C15H15N3O2S2 |
|---|---|
| Molecular Weight | 333.06 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.06058 |
| Heavy Atoms | 22 |
| Complexity | 551.0 |
Chemical Identifiers
| CAS Number | 686771-52-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=O)C3=C(CCS3)N=C2SCC(=O)N |
| InChIKey | KGEIIDQXYHLNIE-UHFFFAOYSA-N |
Product Overview
AB00668723-01 (CAS 686771-52-8), with molecular formula C15H15N3O2S2 and molecular weight 333.06 g/mol. IUPAC: 2-[[3-(4-methylphenyl)-4-oxo-6,7-dihydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide.
Chemical Property Profile of AB00668723-01
Property Insights of AB00668723-01
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00668723-01. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00668723-01. Following Lipinski's Rule of Five, AB00668723-01 has 1 hydrogen bond donor(s) and 5 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 AB00668723-01?
The CAS number of AB00668723-01 is 686771-52-8.
What is the molecular formula of AB00668723-01?
The molecular formula of AB00668723-01 is C15H15N3O2S2.
What is the molecular weight of AB00668723-01?
The molecular weight of AB00668723-01 is 333.06 g/mol.
Where can I buy AB00668723-01?
You can request a quote for AB00668723-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00668723-01?
Yes, KEHONG BIO provides custom synthesis services for AB00668723-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.