ChemDiv1_020908
TL;DR: ChemDiv1_020908 (CAS 330158-92-4) is a chemical compound with molecular formula C20H14ClN3O2 and molecular weight 363.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-acetyl-2-amino-4-(3-chlorophenyl)-4H-pyrano[3,2-b]indole-3-carbonitrile
Also Known As: ChemDiv1_020908, 5-acetyl-2-amino-4-(3-chlorophenyl)-4,5-dihydropyrano[3,2-b]indole-3-carbonitrile, 5-acetyl-2-amino-4-(3-chlorophenyl)-4H-pyrano[3,2-b]indole-3-carbonitrile
| Molecular Formula | C20H14ClN3O2 |
|---|---|
| Molecular Weight | 363.08 g/mol |
| LogP | 4.17298 |
| Topological Polar Surface Area | 81.04 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 363.07745 |
| Heavy Atoms | 26 |
| Complexity | 1137.654 |
Chemical Identifiers
| CAS Number | 330158-92-4 |
|---|---|
| SMILES | CC(=O)N1C2=CC=CC=C2C3=C1C(C(=C(O3)N)C#N)C4=CC(=CC=C4)Cl |
Product Overview
ChemDiv1_020908 (CAS 330158-92-4), with molecular formula C20H14ClN3O2 and molecular weight 363.08 g/mol. IUPAC: 5-acetyl-2-amino-4-(3-chlorophenyl)-4H-pyrano[3,2-b]indole-3-carbonitrile.
Chemical Property Profile of ChemDiv1_020908
Property Insights of ChemDiv1_020908
The XLogP value of 4.17298 indicates that ChemDiv1_020908 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.04 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_020908. Following Lipinski's Rule of Five, ChemDiv1_020908 has 1 hydrogen bond donor(s) and 4 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_020908?
The CAS number of ChemDiv1_020908 is 330158-92-4.
What is the molecular formula of ChemDiv1_020908?
The molecular formula of ChemDiv1_020908 is C20H14ClN3O2.
What is the molecular weight of ChemDiv1_020908?
The molecular weight of ChemDiv1_020908 is 363.08 g/mol.
Where can I buy ChemDiv1_020908?
You can request a quote for ChemDiv1_020908 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_020908?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_020908 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.