![2-Oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid naphthalen-1-yl ester structure](/static/products/3333/333311-02-7.webp)
2-Oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid naphthalen-1-yl ester
TL;DR: 2-Oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid naphthalen-1-yl ester (CAS 333311-02-7) is a chemical compound with molecular formula C21H13NO4S and molecular weight 375.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
naphthalen-1-yl 2-oxo-1H-benzo[cd]indole-6-sulfonate
Also Known As: ChemDiv1_023080, BAS 02106019, naphthalen-1-yl 2-oxo-1H-benzo[cd]indole-6-sulfonate, 1-naphthyl 2-oxo-1,2-dihydrobenzo[cd]indole-6-sulfonate, 2-Oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid naphthalen-1-yl ester
| Molecular Formula | C21H13NO4S |
|---|---|
| Molecular Weight | 375.06 g/mol |
| LogP | 4.3264 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 375.05652 |
| Heavy Atoms | 27 |
| Complexity | 1354.2478 |
Chemical Identifiers
| CAS Number | 333311-02-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2OS(=O)(=O)C3=C4C=CC=C5C4=C(C=C3)NC5=O |
Product Overview
2-Oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid naphthalen-1-yl ester (CAS 333311-02-7), with molecular formula C21H13NO4S and molecular weight 375.06 g/mol. IUPAC: naphthalen-1-yl 2-oxo-1H-benzo[cd]indole-6-sulfonate.
Chemical Property Profile of 2-Oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid naphthalen-1-yl ester
Property Insights of 2-Oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid naphthalen-1-yl ester
The XLogP value of 4.3264 indicates that 2-Oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid naphthalen-1-yl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid naphthalen-1-yl ester. Following Lipinski's Rule of Five, 2-Oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid naphthalen-1-yl ester 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 2-Oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid naphthalen-1-yl ester?
The CAS number of 2-Oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid naphthalen-1-yl ester is 333311-02-7.
What is the molecular formula of 2-Oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid naphthalen-1-yl ester?
The molecular formula of 2-Oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid naphthalen-1-yl ester is C21H13NO4S.
What is the molecular weight of 2-Oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid naphthalen-1-yl ester?
The molecular weight of 2-Oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid naphthalen-1-yl ester is 375.06 g/mol.
Where can I buy 2-Oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid naphthalen-1-yl ester?
You can request a quote for 2-Oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid naphthalen-1-yl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid naphthalen-1-yl ester?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxo-1,2-dihydro-benzo[cd]indole-6-sulfonic acid naphthalen-1-yl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.