BAS 01337619
TL;DR: BAS 01337619 (CAS 337498-13-2) is a chemical compound with molecular formula C31H27N3O2S and molecular weight 505.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-4-(4-methoxyphenyl)-6-(4-methylphenyl)pyridine-3-carbonitrile
Also Known As: BAS 01337619, 2-((2-(3,4-Dihydroquinolin-1(2H)-yl)-2-oxoethyl)thio)-4-(4-methoxyphenyl)-6-(p-tolyl)nicotinonitrile, 2-[2-(3,4-Dihydro-2H-quinolin-1-yl)-2-oxo-ethylsulfanyl]-4-(4-methoxy-phenyl)-6-p-tolyl-nicotinonitrile, 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-4-(4-methoxyphenyl)-6-(4-methylphenyl)pyridine-3-carbonitrile, 2-{[2-(3,4-dihydro-1(2H)-quinolinyl)-2-oxoethyl]sulfanyl}-4-(4-methoxyphenyl)-6-(4-methylphenyl)nicotinonitrile
| Molecular Formula | C31H27N3O2S |
|---|---|
| Molecular Weight | 505.18 g/mol |
| LogP | 6.6758 |
| Topological Polar Surface Area | 66.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 505.1824 |
| Heavy Atoms | 37 |
| Complexity | 1474.3145 |
Chemical Identifiers
| CAS Number | 337498-13-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=C(C=C3)OC)C#N)SCC(=O)N4CCCC5=CC=CC=C54 |
Product Overview
BAS 01337619 (CAS 337498-13-2), with molecular formula C31H27N3O2S and molecular weight 505.18 g/mol. IUPAC: 2-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]sulfanyl-4-(4-methoxyphenyl)-6-(4-methylphenyl)pyridine-3-carbonitrile.
Chemical Property Profile of BAS 01337619
Property Insights of BAS 01337619
The XLogP value of 6.6758 indicates that BAS 01337619 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.22 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 01337619. Following Lipinski's Rule of Five, BAS 01337619 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 01337619?
The CAS number of BAS 01337619 is 337498-13-2.
What is the molecular formula of BAS 01337619?
The molecular formula of BAS 01337619 is C31H27N3O2S.
What is the molecular weight of BAS 01337619?
The molecular weight of BAS 01337619 is 505.18 g/mol.
Where can I buy BAS 01337619?
You can request a quote for BAS 01337619 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 01337619?
Yes, KEHONG BIO provides custom synthesis services for BAS 01337619 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.