ChemDiv1_019261
TL;DR: ChemDiv1_019261 (CAS 313364-94-2) is a chemical compound with molecular formula C24H23N3O4S and molecular weight 449.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-ethyl-2-oxobenzo[cd]indol-6-yl)-4-pyrrolidin-1-ylsulfonylbenzamide
Also Known As: ChemDiv1_019261, F0012-0239, N-(1-ethyl-2-oxo-1,2-dihydrobenzo[cd]indol-6-yl)-4-(pyrrolidin-1-ylsulfonyl)benzamide, N-(1-ethyl-2-oxobenzo[cd]indol-6-yl)-4-pyrrolidin-1-ylsulfonylbenzamide, N-{2-ethyl-3-oxo-2-azatricyclo[6.3.1.0^{4,12}]dodeca-1(11),4,6,8(12),9-pentaen-9-yl}-4-(pyrrolidine-1-sulfonyl)benzamide
| Molecular Formula | C24H23N3O4S |
|---|---|
| Molecular Weight | 449.14 g/mol |
| LogP | 3.8567 |
| Topological Polar Surface Area | 86.79 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 449.14093 |
| Heavy Atoms | 32 |
| Complexity | 1343.667 |
Chemical Identifiers
| CAS Number | 313364-94-2 |
|---|---|
| SMILES | CCN1C2=C3C(=C(C=C2)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC5)C=CC=C3C1=O |
Product Overview
ChemDiv1_019261 (CAS 313364-94-2), with molecular formula C24H23N3O4S and molecular weight 449.14 g/mol. IUPAC: N-(1-ethyl-2-oxobenzo[cd]indol-6-yl)-4-pyrrolidin-1-ylsulfonylbenzamide.
Chemical Property Profile of ChemDiv1_019261
Property Insights of ChemDiv1_019261
The XLogP value of 3.8567 indicates that ChemDiv1_019261 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.79 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_019261. Following Lipinski's Rule of Five, ChemDiv1_019261 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_019261?
The CAS number of ChemDiv1_019261 is 313364-94-2.
What is the molecular formula of ChemDiv1_019261?
The molecular formula of ChemDiv1_019261 is C24H23N3O4S.
What is the molecular weight of ChemDiv1_019261?
The molecular weight of ChemDiv1_019261 is 449.14 g/mol.
Where can I buy ChemDiv1_019261?
You can request a quote for ChemDiv1_019261 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_019261?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_019261 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.