ChemDiv1_017179
TL;DR: ChemDiv1_017179 (CAS 434291-10-8) is a chemical compound with molecular formula C21H17N3O2S and molecular weight 375.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-8-(furan-2-yl)-N-phenyl-4-thia-2-azatricyclo[7.3.0.03,7]dodeca-1(9),2,5,7-tetraene-5-carboxamide
Also Known As: ChemDiv1_017179, 3-Amino-4-furan-2-yl-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxylic acid phenylamide, 6-amino-8-(furan-2-yl)-N-phenyl-4-thia-2-azatricyclo[7.3.0.03,7]dodeca-1(9),2,5,7-tetraene-5-carboxamide, 3-amino-4-(furan-2-yl)-N-phenyl-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide, 3-amino-4-(2-furyl)-N-phenyl-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carboxamide
| Molecular Formula | C21H17N3O2S |
|---|---|
| Molecular Weight | 375.10 g/mol |
| LogP | 4.8795 |
| Topological Polar Surface Area | 81.15 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 375.10416 |
| Heavy Atoms | 27 |
| Complexity | 1147.61 |
Chemical Identifiers
| CAS Number | 434291-10-8 |
|---|---|
| SMILES | C1CC2=C(C1)N=C3C(=C2C4=CC=CO4)C(=C(S3)C(=O)NC5=CC=CC=C5)N |
Product Overview
ChemDiv1_017179 (CAS 434291-10-8), with molecular formula C21H17N3O2S and molecular weight 375.10 g/mol. IUPAC: 6-amino-8-(furan-2-yl)-N-phenyl-4-thia-2-azatricyclo[7.3.0.03,7]dodeca-1(9),2,5,7-tetraene-5-carboxamide.
Chemical Property Profile of ChemDiv1_017179
Property Insights of ChemDiv1_017179
The XLogP value of 4.8795 indicates that ChemDiv1_017179 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_017179. Following Lipinski's Rule of Five, ChemDiv1_017179 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_017179?
The CAS number of ChemDiv1_017179 is 434291-10-8.
What is the molecular formula of ChemDiv1_017179?
The molecular formula of ChemDiv1_017179 is C21H17N3O2S.
What is the molecular weight of ChemDiv1_017179?
The molecular weight of ChemDiv1_017179 is 375.10 g/mol.
Where can I buy ChemDiv1_017179?
You can request a quote for ChemDiv1_017179 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_017179?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_017179 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.