AB00718149-01
TL;DR: AB00718149-01 (CAS 379243-85-3) is a chemical compound with molecular formula C16H13ClFN3OS2 and molecular weight 381.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-fluorophenyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide
Also Known As: AB00718149-01, AF-399/40684211, 2-(5,6-dimethylthiopheno[3,2-e]pyrimidin-4-ylthio)-N-(3-chloro-4-fluorophenyl) acetamide, N-(3-chloro-4-fluorophenyl)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl]acetamide
| Molecular Formula | C16H13ClFN3OS2 |
|---|---|
| Molecular Weight | 381.02 g/mol |
| LogP | 4.83144 |
| Topological Polar Surface Area | 54.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 381.01727 |
| Heavy Atoms | 24 |
| Complexity | 929.07166 |
Chemical Identifiers
| CAS Number | 379243-85-3 |
|---|---|
| SMILES | CC1=C(SC2=C1C(=NC=N2)SCC(=O)NC3=CC(=C(C=C3)F)Cl)C |
Product Overview
AB00718149-01 (CAS 379243-85-3), with molecular formula C16H13ClFN3OS2 and molecular weight 381.02 g/mol. IUPAC: N-(3-chloro-4-fluorophenyl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide.
Chemical Property Profile of AB00718149-01
Property Insights of AB00718149-01
The XLogP value of 4.83144 indicates that AB00718149-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.88 Ų, AB00718149-01 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AB00718149-01 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 AB00718149-01?
The CAS number of AB00718149-01 is 379243-85-3.
What is the molecular formula of AB00718149-01?
The molecular formula of AB00718149-01 is C16H13ClFN3OS2.
What is the molecular weight of AB00718149-01?
The molecular weight of AB00718149-01 is 381.02 g/mol.
Where can I buy AB00718149-01?
You can request a quote for AB00718149-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00718149-01?
Yes, KEHONG BIO provides custom synthesis services for AB00718149-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.