BAS 15807831
TL;DR: BAS 15807831 (CAS 879138-70-2) is a chemical compound with molecular formula C21H15ClFN3O3S and molecular weight 443.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chlorophenyl)-2-[3-[(4-fluorophenyl)methyl]-2,4-dioxothieno[3,2-d]pyrimidin-1-yl]acetamide
Also Known As: BAS 15807831, F6609-0816, N-(2-chlorophenyl)-2-(3-(4-fluorobenzyl)-2,4-dioxo-3,4-dihydrothieno[3,2-d]pyrimidin-1(2H)-yl)acetamide, N-(2-chlorophenyl)-2-[3-[(4-fluorophenyl)methyl]-2,4-dioxothieno[3,2-d]pyrimidin-1-yl]acetamide, N-(2-chlorophenyl)-2-{3-[(4-fluorophenyl)methyl]-2,4-dioxo-1H,2H,3H,4H-thieno[3,2-d]pyrimidin-1-yl}acetamide
| Molecular Formula | C21H15ClFN3O3S |
|---|---|
| Molecular Weight | 443.05 g/mol |
| LogP | 3.7042 |
| Topological Polar Surface Area | 73.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 443.05066 |
| Heavy Atoms | 30 |
| Complexity | 1358.6771 |
Chemical Identifiers
| CAS Number | 879138-70-2 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NC(=O)CN2C3=C(C(=O)N(C2=O)CC4=CC=C(C=C4)F)SC=C3)Cl |
Product Overview
BAS 15807831 (CAS 879138-70-2), with molecular formula C21H15ClFN3O3S and molecular weight 443.05 g/mol. IUPAC: N-(2-chlorophenyl)-2-[3-[(4-fluorophenyl)methyl]-2,4-dioxothieno[3,2-d]pyrimidin-1-yl]acetamide.
Chemical Property Profile of BAS 15807831
Property Insights of BAS 15807831
The XLogP value of 3.7042 indicates that BAS 15807831 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.1 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 15807831. Following Lipinski's Rule of Five, BAS 15807831 has 1 hydrogen bond donor(s) and 4 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 BAS 15807831?
The CAS number of BAS 15807831 is 879138-70-2.
What is the molecular formula of BAS 15807831?
The molecular formula of BAS 15807831 is C21H15ClFN3O3S.
What is the molecular weight of BAS 15807831?
The molecular weight of BAS 15807831 is 443.05 g/mol.
Where can I buy BAS 15807831?
You can request a quote for BAS 15807831 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 15807831?
Yes, KEHONG BIO provides custom synthesis services for BAS 15807831 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.