BAS 11177147
TL;DR: BAS 11177147 (CAS 799795-96-3) is a chemical compound with molecular formula C25H25N3O3S and molecular weight 447.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-cyano-4-(furan-2-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]-N-(2-ethyl-6-methylphenyl)acetamide
Also Known As: BAS 11177147, J3.557.357G, AO-022/42435147, 2-((3-cyano-4-(furan-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl)thio)-N-(2-ethyl-6-methylphenyl)acetamide, 2-{[3-cyano-4-(furan-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(2-ethyl-6-methylphenyl)acetamide
| Molecular Formula | C25H25N3O3S |
|---|---|
| Molecular Weight | 447.16 g/mol |
| LogP | 4.9514 |
| Topological Polar Surface Area | 95.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 447.16165 |
| Heavy Atoms | 32 |
| Complexity | 1155.59 |
Chemical Identifiers
| CAS Number | 799795-96-3 |
|---|---|
| SMILES | CCC1=CC=CC(=C1NC(=O)CSC2=C(C(C3=C(N2)CCCC3=O)C4=CC=CO4)C#N)C |
Product Overview
BAS 11177147 (CAS 799795-96-3), with molecular formula C25H25N3O3S and molecular weight 447.16 g/mol. IUPAC: 2-[[3-cyano-4-(furan-2-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]-N-(2-ethyl-6-methylphenyl)acetamide.
Chemical Property Profile of BAS 11177147
Property Insights of BAS 11177147
The XLogP value of 4.9514 indicates that BAS 11177147 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.13 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 11177147. Following Lipinski's Rule of Five, BAS 11177147 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 11177147?
The CAS number of BAS 11177147 is 799795-96-3.
What is the molecular formula of BAS 11177147?
The molecular formula of BAS 11177147 is C25H25N3O3S.
What is the molecular weight of BAS 11177147?
The molecular weight of BAS 11177147 is 447.16 g/mol.
Where can I buy BAS 11177147?
You can request a quote for BAS 11177147 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 11177147?
Yes, KEHONG BIO provides custom synthesis services for BAS 11177147 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.