RefChem:462986
TL;DR: RefChem:462986 (CAS 476483-90-6) is a chemical compound with molecular formula C24H23ClN4O3S and molecular weight 482.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-1-(2-chloro-4-nitrophenyl)-4-(2,5-dimethylthiophen-3-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile
Also Known As: 2-Amino-1-(2-chloro-4-nitrophenyl)-4-(2,5-dimethylthiophen-3-yl)-7,7-dimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile, 2-AMINO-1-(2-CHLORO-4-NITROPHENYL)-4-(2,5-DIMETHYL-3-THIENYL)-7,7-DIMETHYL-5-OXO-1,4,5,6,7,8-HEXAHYDRO-3-QUINOLINECARBONITRILE, 2-amino-1-(2-chloro-4-nitrophenyl)-4-(2,5-dimethylthiophen-3-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile, 647-854-6, RefChem:462986
| Molecular Formula | C24H23ClN4O3S |
|---|---|
| Molecular Weight | 482.12 g/mol |
| LogP | 5.86742 |
| Topological Polar Surface Area | 113.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 482.11795 |
| Heavy Atoms | 33 |
| Complexity | 1315.447 |
Chemical Identifiers
| CAS Number | 476483-90-6 |
|---|---|
| SMILES | CC1=CC(=C(S1)C)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=C(C=C(C=C4)[N+](=O)[O-])Cl)N)C#N |
Product Overview
RefChem:462986 (CAS 476483-90-6), with molecular formula C24H23ClN4O3S and molecular weight 482.12 g/mol. IUPAC: 2-amino-1-(2-chloro-4-nitrophenyl)-4-(2,5-dimethylthiophen-3-yl)-7,7-dimethyl-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile.
Chemical Property Profile of RefChem:462986
Property Insights of RefChem:462986
The XLogP value of 5.86742 indicates that RefChem:462986 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.26 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:462986. Following Lipinski's Rule of Five, RefChem:462986 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:462986?
The CAS number of RefChem:462986 is 476483-90-6.
What is the molecular formula of RefChem:462986?
The molecular formula of RefChem:462986 is C24H23ClN4O3S.
What is the molecular weight of RefChem:462986?
The molecular weight of RefChem:462986 is 482.12 g/mol.
Where can I buy RefChem:462986?
You can request a quote for RefChem:462986 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:462986?
Yes, KEHONG BIO provides custom synthesis services for RefChem:462986 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.