AB00764799-01
TL;DR: AB00764799-01 (CAS 577983-76-7) is a chemical compound with molecular formula C19H17F2N3O2S2 and molecular weight 421.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-difluorophenyl)-2-[(3-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
Also Known As: AB00764799-01, N-(2,4-difluorophenyl)-2-({4-methyl-3-oxo-8-thia-4,6-diazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-5-yl}sulfanyl)acetamide, N-(2,4-difluorophenyl)-2-((3-methyl-4-oxo-3,4,5,6,7,8-hexahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2-yl)thio)acetamide, N-(2,4-difluorophenyl)-2-(3-methyl-4-oxo(3,5,6,7,8-pentahydrobenzo[b]thiopheno [2,3-d]pyrimidin-2-ylthio))acetamide, N-(2,4-difluorophenyl)-2-[(3-methyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
| Molecular Formula | C19H17F2N3O2S2 |
|---|---|
| Molecular Weight | 421.07 g/mol |
| LogP | 3.8828 |
| Topological Polar Surface Area | 63.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 421.07303 |
| Heavy Atoms | 28 |
| Complexity | 1140.3896 |
Chemical Identifiers
| CAS Number | 577983-76-7 |
|---|---|
| SMILES | CN1C(=O)C2=C(N=C1SCC(=O)NC3=C(C=C(C=C3)F)F)SC4=C2CCCC4 |
Product Overview
AB00764799-01 (CAS 577983-76-7), with molecular formula C19H17F2N3O2S2 and molecular weight 421.07 g/mol. IUPAC: N-(2,4-difluorophenyl)-2-[(3-methyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide.
Chemical Property Profile of AB00764799-01
Property Insights of AB00764799-01
The XLogP value of 3.8828 indicates that AB00764799-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.99 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00764799-01. Following Lipinski's Rule of Five, AB00764799-01 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 AB00764799-01?
The CAS number of AB00764799-01 is 577983-76-7.
What is the molecular formula of AB00764799-01?
The molecular formula of AB00764799-01 is C19H17F2N3O2S2.
What is the molecular weight of AB00764799-01?
The molecular weight of AB00764799-01 is 421.07 g/mol.
Where can I buy AB00764799-01?
You can request a quote for AB00764799-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00764799-01?
Yes, KEHONG BIO provides custom synthesis services for AB00764799-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.