ChemDiv1_016990
TL;DR: ChemDiv1_016990 (CAS 434294-20-9) is a chemical compound with molecular formula C23H21N3O2S and molecular weight 403.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-N-benzyl-4-(furan-2-yl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
Also Known As: ChemDiv1_016990, 3-amino-N-benzyl-4-(furan-2-yl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide, AE-848/41828129, 3-amino-N-benzyl-4-(2-furyl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide, 3-AMINO-N-BENZYL-4-(FURAN-2-YL)-5H,6H,7H,8H-THIENO[2,3-B]QUINOLINE-2-CARBOXAMIDE
| Molecular Formula | C23H21N3O2S |
|---|---|
| Molecular Weight | 403.14 g/mol |
| LogP | 4.9473 |
| Topological Polar Surface Area | 81.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 403.13544 |
| Heavy Atoms | 29 |
| Complexity | 1180.2876 |
Chemical Identifiers
| CAS Number | 434294-20-9 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C3C(=C(SC3=N2)C(=O)NCC4=CC=CC=C4)N)C5=CC=CO5 |
Product Overview
ChemDiv1_016990 (CAS 434294-20-9), with molecular formula C23H21N3O2S and molecular weight 403.14 g/mol. IUPAC: 3-amino-N-benzyl-4-(furan-2-yl)-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide.
Chemical Property Profile of ChemDiv1_016990
Property Insights of ChemDiv1_016990
The XLogP value of 4.9473 indicates that ChemDiv1_016990 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.15 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_016990. Following Lipinski's Rule of Five, ChemDiv1_016990 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_016990?
The CAS number of ChemDiv1_016990 is 434294-20-9.
What is the molecular formula of ChemDiv1_016990?
The molecular formula of ChemDiv1_016990 is C23H21N3O2S.
What is the molecular weight of ChemDiv1_016990?
The molecular weight of ChemDiv1_016990 is 403.14 g/mol.
Where can I buy ChemDiv1_016990?
You can request a quote for ChemDiv1_016990 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_016990?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_016990 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.