AB00685603-01
TL;DR: AB00685603-01 (CAS 438489-11-3) is a chemical compound with molecular formula C19H20N4O3S and molecular weight 384.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethyl-N-(3-imidazol-1-ylpropyl)-2-oxobenzo[cd]indole-6-sulfonamide
Also Known As: AB00685603-01, F1094-0312, 1-ethyl-N-(3-imidazol-1-ylpropyl)-2-oxobenzo[cd]indole-6-sulfonamide, 2-ethyl-N-[3-(1H-imidazol-1-yl)propyl]-3-oxo-2-azatricyclo[6.3.1.0^{4,12}]dodeca-1(12),4,6,8,10-pentaene-9-sulfonamide, 1-ethyl-2-oxo-1-aza-6-acenaphthenyl[3-(1-imidazolyl)propylamino](oxo)-lambda-sulfaniumolate
| Molecular Formula | C19H20N4O3S |
|---|---|
| Molecular Weight | 384.13 g/mol |
| LogP | 2.385 |
| Topological Polar Surface Area | 84.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 384.1256 |
| Heavy Atoms | 27 |
| Complexity | 1107.4401 |
Chemical Identifiers
| CAS Number | 438489-11-3 |
|---|---|
| SMILES | CCN1C2=C3C(=C(C=C2)S(=O)(=O)NCCCN4C=CN=C4)C=CC=C3C1=O |
Product Overview
AB00685603-01 (CAS 438489-11-3), with molecular formula C19H20N4O3S and molecular weight 384.13 g/mol. IUPAC: 1-ethyl-N-(3-imidazol-1-ylpropyl)-2-oxobenzo[cd]indole-6-sulfonamide.
Chemical Property Profile of AB00685603-01
Property Insights of AB00685603-01
The XLogP value of 2.385 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00685603-01. The TPSA of 84.3 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00685603-01. Following Lipinski's Rule of Five, AB00685603-01 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 AB00685603-01?
The CAS number of AB00685603-01 is 438489-11-3.
What is the molecular formula of AB00685603-01?
The molecular formula of AB00685603-01 is C19H20N4O3S.
What is the molecular weight of AB00685603-01?
The molecular weight of AB00685603-01 is 384.13 g/mol.
Where can I buy AB00685603-01?
You can request a quote for AB00685603-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00685603-01?
Yes, KEHONG BIO provides custom synthesis services for AB00685603-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.