RefChem:463150
TL;DR: RefChem:463150 (CAS 311334-36-8) is a chemical compound with molecular formula C21H17ClN4O and molecular weight 376.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-1-(4-chlorophenyl)-5-oxo-4-pyridin-3-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile
Also Known As: 2-amino-1-(4-chlorophenyl)-5-oxo-4-(pyridin-3-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile, A1179/0054645, 2-AMINO-1-(4-CHLOROPHENYL)-5-OXO-4-(3-PYRIDINYL)-1,4,5,6,7,8-HEXAHYDRO-3-QUINOLINECARBONITRILE, 2-amino-1-(4-chlorophenyl)-5-oxo-4-pyridin-3-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile, 648-139-1
| Molecular Formula | C21H17ClN4O |
|---|---|
| Molecular Weight | 376.11 g/mol |
| LogP | 4.03978 |
| Topological Polar Surface Area | 83.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 376.1091 |
| Heavy Atoms | 27 |
| Complexity | 1002.7272 |
Chemical Identifiers
| CAS Number | 311334-36-8 |
|---|---|
| SMILES | C1CC2=C(C(C(=C(N2C3=CC=C(C=C3)Cl)N)C#N)C4=CN=CC=C4)C(=O)C1 |
Product Overview
RefChem:463150 (CAS 311334-36-8), with molecular formula C21H17ClN4O and molecular weight 376.11 g/mol. IUPAC: 2-amino-1-(4-chlorophenyl)-5-oxo-4-pyridin-3-yl-4,6,7,8-tetrahydroquinoline-3-carbonitrile.
Chemical Property Profile of RefChem:463150
Property Insights of RefChem:463150
The XLogP value of 4.03978 indicates that RefChem:463150 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.01 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:463150. Following Lipinski's Rule of Five, RefChem:463150 has 1 hydrogen bond donor(s) and 5 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 RefChem:463150?
The CAS number of RefChem:463150 is 311334-36-8.
What is the molecular formula of RefChem:463150?
The molecular formula of RefChem:463150 is C21H17ClN4O.
What is the molecular weight of RefChem:463150?
The molecular weight of RefChem:463150 is 376.11 g/mol.
Where can I buy RefChem:463150?
You can request a quote for RefChem:463150 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:463150?
Yes, KEHONG BIO provides custom synthesis services for RefChem:463150 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.