ChemDiv1_009311
TL;DR: ChemDiv1_009311 (CAS 441783-28-4) is a chemical compound with molecular formula C24H24N4O3S and molecular weight 448.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-4-(2,5-dimethylthiophen-3-yl)-7,7-dimethyl-1-(3-nitrophenyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile
Also Known As: ChemDiv1_009311, 2-Amino-4-(2,5-dimethylthiophen-3-yl)-7,7-dimethyl-1-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile, 2-amino-4-(2,5-dimethyl-3-thienyl)-7,7-dimethyl-1-(3-nitrophenyl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile, 2-amino-4-(2,5-dimethylthiophen-3-yl)-7,7-dimethyl-1-(3-nitrophenyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile, 647-806-4
| Molecular Formula | C24H24N4O3S |
|---|---|
| Molecular Weight | 448.16 g/mol |
| LogP | 5.21402 |
| Topological Polar Surface Area | 113.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 448.15692 |
| Heavy Atoms | 32 |
| Complexity | 1262.2722 |
Chemical Identifiers
| CAS Number | 441783-28-4 |
|---|---|
| SMILES | CC1=CC(=C(S1)C)C2C(=C(N(C3=C2C(=O)CC(C3)(C)C)C4=CC(=CC=C4)[N+](=O)[O-])N)C#N |
Product Overview
ChemDiv1_009311 (CAS 441783-28-4), with molecular formula C24H24N4O3S and molecular weight 448.16 g/mol. IUPAC: 2-amino-4-(2,5-dimethylthiophen-3-yl)-7,7-dimethyl-1-(3-nitrophenyl)-5-oxo-6,8-dihydro-4H-quinoline-3-carbonitrile.
Chemical Property Profile of ChemDiv1_009311
Property Insights of ChemDiv1_009311
The XLogP value of 5.21402 indicates that ChemDiv1_009311 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 ChemDiv1_009311. Following Lipinski's Rule of Five, ChemDiv1_009311 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 ChemDiv1_009311?
The CAS number of ChemDiv1_009311 is 441783-28-4.
What is the molecular formula of ChemDiv1_009311?
The molecular formula of ChemDiv1_009311 is C24H24N4O3S.
What is the molecular weight of ChemDiv1_009311?
The molecular weight of ChemDiv1_009311 is 448.16 g/mol.
Where can I buy ChemDiv1_009311?
You can request a quote for ChemDiv1_009311 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_009311?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_009311 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.