BAS 11177182
TL;DR: BAS 11177182 (CAS 799799-35-2) is a chemical compound with molecular formula C22H20FN3O4S and molecular weight 441.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-cyano-4-(3,4-dimethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(2-fluorophenyl)acetamide
Also Known As: BAS 11177182, AB01278441-01, F1362-0153, 2-((3-cyano-4-(3,4-dimethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl)thio)-N-(2-fluorophenyl)acetamide, 2-{[3-cyano-4-(3,4-dimethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(2-fluorophenyl)acetamide
| Molecular Formula | C22H20FN3O4S |
|---|---|
| Molecular Weight | 441.12 g/mol |
| LogP | 3.55348 |
| Topological Polar Surface Area | 100.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 441.11584 |
| Heavy Atoms | 31 |
| Complexity | 1080.666 |
Chemical Identifiers
| CAS Number | 799799-35-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2CC(=O)NC(=C2C#N)SCC(=O)NC3=CC=CC=C3F)OC |
Product Overview
BAS 11177182 (CAS 799799-35-2), with molecular formula C22H20FN3O4S and molecular weight 441.12 g/mol. IUPAC: 2-[[5-cyano-4-(3,4-dimethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(2-fluorophenyl)acetamide.
Chemical Property Profile of BAS 11177182
Property Insights of BAS 11177182
The XLogP value of 3.55348 indicates that BAS 11177182 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 100.45 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 11177182. Following Lipinski's Rule of Five, BAS 11177182 has 2 hydrogen bond donor(s) and 6 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 11177182?
The CAS number of BAS 11177182 is 799799-35-2.
What is the molecular formula of BAS 11177182?
The molecular formula of BAS 11177182 is C22H20FN3O4S.
What is the molecular weight of BAS 11177182?
The molecular weight of BAS 11177182 is 441.12 g/mol.
Where can I buy BAS 11177182?
You can request a quote for BAS 11177182 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 11177182?
Yes, KEHONG BIO provides custom synthesis services for BAS 11177182 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.