ChemDiv1_028778
TL;DR: ChemDiv1_028778 (CAS 384358-02-5) is a chemical compound with molecular formula C20H18ClN3O2S and molecular weight 399.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-N-(4-chlorophenyl)-7,7-dimethyl-5-oxo-6,8-dihydrothieno[2,3-b]quinoline-2-carboxamide
Also Known As: ChemDiv1_028778, 3-amino-N-(4-chlorophenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide, 3-amino-N-(4-chlorophenyl)-7,7-dimethyl-5-oxo-6,8-dihydrothieno[2,3-b]quinoline-2-carboxamide, 3-AMINO-N-(4-CHLOROPHENYL)-7,7-DIMETHYL-5-OXO-5H,6H,7H,8H-THIENO[2,3-B]QUINOLINE-2-CARBOXAMIDE
| Molecular Formula | C20H18ClN3O2S |
|---|---|
| Molecular Weight | 399.08 g/mol |
| LogP | 4.9393 |
| Topological Polar Surface Area | 85.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 399.0808 |
| Heavy Atoms | 27 |
| Complexity | 1086.795 |
Chemical Identifiers
| CAS Number | 384358-02-5 |
|---|---|
| SMILES | CC1(CC2=C(C=C3C(=C(SC3=N2)C(=O)NC4=CC=C(C=C4)Cl)N)C(=O)C1)C |
Product Overview
ChemDiv1_028778 (CAS 384358-02-5), with molecular formula C20H18ClN3O2S and molecular weight 399.08 g/mol. IUPAC: 3-amino-N-(4-chlorophenyl)-7,7-dimethyl-5-oxo-6,8-dihydrothieno[2,3-b]quinoline-2-carboxamide.
Chemical Property Profile of ChemDiv1_028778
Property Insights of ChemDiv1_028778
The XLogP value of 4.9393 indicates that ChemDiv1_028778 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.08 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_028778. Following Lipinski's Rule of Five, ChemDiv1_028778 has 2 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 ChemDiv1_028778?
The CAS number of ChemDiv1_028778 is 384358-02-5.
What is the molecular formula of ChemDiv1_028778?
The molecular formula of ChemDiv1_028778 is C20H18ClN3O2S.
What is the molecular weight of ChemDiv1_028778?
The molecular weight of ChemDiv1_028778 is 399.08 g/mol.
Where can I buy ChemDiv1_028778?
You can request a quote for ChemDiv1_028778 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_028778?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_028778 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.