AB00675381-01
TL;DR: AB00675381-01 (CAS 866846-01-7) is a chemical compound with molecular formula C20H17N3O3S and molecular weight 379.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-[(4-methylphenyl)methyl]-4-oxo-[1]benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide
Also Known As: AB00675381-01, F1605-1122, 2-((3-(4-methylbenzyl)-4-oxo-3,4-dihydrobenzofuro[3,2-d]pyrimidin-2-yl)thio)acetamide, 2-[[3-[(4-methylphenyl)methyl]-4-oxo-[1]benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide, 2-{[3-(4-METHYLBENZYL)-4-OXO-3,4-DIHYDRO[1]BENZOFURO[3,2-D]PYRIMIDIN-2-YL]SULFANYL}ACETAMIDE
| Molecular Formula | C20H17N3O3S |
|---|---|
| Molecular Weight | 379.10 g/mol |
| LogP | 3.07682 |
| Topological Polar Surface Area | 91.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 379.09906 |
| Heavy Atoms | 27 |
| Complexity | 1209.078 |
Chemical Identifiers
| CAS Number | 866846-01-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CN2C(=O)C3=C(C4=CC=CC=C4O3)N=C2SCC(=O)N |
Product Overview
AB00675381-01 (CAS 866846-01-7), with molecular formula C20H17N3O3S and molecular weight 379.10 g/mol. IUPAC: 2-[[3-[(4-methylphenyl)methyl]-4-oxo-[1]benzofuro[3,2-d]pyrimidin-2-yl]sulfanyl]acetamide.
Chemical Property Profile of AB00675381-01
Property Insights of AB00675381-01
The XLogP value of 3.07682 indicates that AB00675381-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.12 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00675381-01. Following Lipinski's Rule of Five, AB00675381-01 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 AB00675381-01?
The CAS number of AB00675381-01 is 866846-01-7.
What is the molecular formula of AB00675381-01?
The molecular formula of AB00675381-01 is C20H17N3O3S.
What is the molecular weight of AB00675381-01?
The molecular weight of AB00675381-01 is 379.10 g/mol.
Where can I buy AB00675381-01?
You can request a quote for AB00675381-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00675381-01?
Yes, KEHONG BIO provides custom synthesis services for AB00675381-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.