BAS 04377373
TL;DR: BAS 04377373 (CAS 312622-82-5) is a chemical compound with molecular formula C18H15F3N2O and molecular weight 332.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-oxo-4-[2-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile
Also Known As: BAS 04377373, AB00099421-01, 2-methyl-5-oxo-4-[2-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile, 2-methyl-5-oxo-4-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile, 2-methyl-5-oxo-4-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
| Molecular Formula | C18H15F3N2O |
|---|---|
| Molecular Weight | 332.11 g/mol |
| LogP | 4.19688 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 332.11365 |
| Heavy Atoms | 24 |
| Complexity | 812.28815 |
Chemical Identifiers
| CAS Number | 312622-82-5 |
|---|---|
| SMILES | CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=CC=C3C(F)(F)F)C#N |
Product Overview
BAS 04377373 (CAS 312622-82-5), with molecular formula C18H15F3N2O and molecular weight 332.11 g/mol. IUPAC: 2-methyl-5-oxo-4-[2-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-1H-quinoline-3-carbonitrile.
Chemical Property Profile of BAS 04377373
Property Insights of BAS 04377373
The XLogP value of 4.19688 indicates that BAS 04377373 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.89 Ų, BAS 04377373 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 04377373 has 1 hydrogen bond donor(s) and 3 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 04377373?
The CAS number of BAS 04377373 is 312622-82-5.
What is the molecular formula of BAS 04377373?
The molecular formula of BAS 04377373 is C18H15F3N2O.
What is the molecular weight of BAS 04377373?
The molecular weight of BAS 04377373 is 332.11 g/mol.
Where can I buy BAS 04377373?
You can request a quote for BAS 04377373 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04377373?
Yes, KEHONG BIO provides custom synthesis services for BAS 04377373 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.