ChemDiv3_007218
TL;DR: ChemDiv3_007218 (CAS 690641-03-3) is a chemical compound with molecular formula C20H17N3O4 and molecular weight 363.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-imidazol-1-ylpropyl)-2-methyl-4,9-dioxobenzo[f][1]benzofuran-3-carboxamide
Also Known As: ChemDiv3_007218, IDI1_025128, AB00686346-01, F1654-0398, BRD-K74117332-001-01-5
| Molecular Formula | C20H17N3O4 |
|---|---|
| Molecular Weight | 363.12 g/mol |
| LogP | 2.38002 |
| Topological Polar Surface Area | 94.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 363.12192 |
| Heavy Atoms | 27 |
| Complexity | 1047.3737 |
Chemical Identifiers
| CAS Number | 690641-03-3 |
|---|---|
| SMILES | CC1=C(C2=C(O1)C(=O)C3=CC=CC=C3C2=O)C(=O)NCCCN4C=CN=C4 |
Product Overview
ChemDiv3_007218 (CAS 690641-03-3), with molecular formula C20H17N3O4 and molecular weight 363.12 g/mol. IUPAC: N-(3-imidazol-1-ylpropyl)-2-methyl-4,9-dioxobenzo[f][1]benzofuran-3-carboxamide.
Chemical Property Profile of ChemDiv3_007218
Property Insights of ChemDiv3_007218
The XLogP value of 2.38002 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv3_007218. The TPSA of 94.2 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_007218. Following Lipinski's Rule of Five, ChemDiv3_007218 has 1 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 ChemDiv3_007218?
The CAS number of ChemDiv3_007218 is 690641-03-3.
What is the molecular formula of ChemDiv3_007218?
The molecular formula of ChemDiv3_007218 is C20H17N3O4.
What is the molecular weight of ChemDiv3_007218?
The molecular weight of ChemDiv3_007218 is 363.12 g/mol.
Where can I buy ChemDiv3_007218?
You can request a quote for ChemDiv3_007218 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_007218?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_007218 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.