![N-(1,3-dioxoisoindolin-5-yl)-5-nitrobenzo[b]thiophene-2-carboxamide structure](/static/products/6832/683235-53-2.webp)
N-(1,3-dioxoisoindolin-5-yl)-5-nitrobenzo[b]thiophene-2-carboxamide
TL;DR: N-(1,3-dioxoisoindolin-5-yl)-5-nitrobenzo[b]thiophene-2-carboxamide (CAS 683235-53-2) is a chemical compound with molecular formula C17H9N3O5S and molecular weight 367.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-dioxoisoindol-5-yl)-5-nitro-1-benzothiophene-2-carboxamide
Also Known As: N-(1,3-dioxoisoindolin-5-yl)-5-nitrobenzo[b]thiophene-2-carboxamide, F1105-0186, N-(1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)-5-nitro-1-benzothiophene-2-carboxamide, N-(1,3-dioxoisoindol-5-yl)-5-nitro-1-benzothiophene-2-carboxamide
| Molecular Formula | C17H9N3O5S |
|---|---|
| Molecular Weight | 367.03 g/mol |
| LogP | 2.9454 |
| Topological Polar Surface Area | 118.41 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 367.0263 |
| Heavy Atoms | 26 |
| Complexity | 1134.6288 |
Chemical Identifiers
| CAS Number | 683235-53-2 |
|---|---|
| SMILES | C1=CC2=C(C=C1NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-])C(=O)NC2=O |
Product Overview
N-(1,3-dioxoisoindolin-5-yl)-5-nitrobenzo[b]thiophene-2-carboxamide (CAS 683235-53-2), with molecular formula C17H9N3O5S and molecular weight 367.03 g/mol. IUPAC: N-(1,3-dioxoisoindol-5-yl)-5-nitro-1-benzothiophene-2-carboxamide.
Chemical Property Profile of N-(1,3-dioxoisoindolin-5-yl)-5-nitrobenzo[b]thiophene-2-carboxamide
Property Insights of N-(1,3-dioxoisoindolin-5-yl)-5-nitrobenzo[b]thiophene-2-carboxamide
The XLogP value of 2.9454 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,3-dioxoisoindolin-5-yl)-5-nitrobenzo[b]thiophene-2-carboxamide. The TPSA of 118.41 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1,3-dioxoisoindolin-5-yl)-5-nitrobenzo[b]thiophene-2-carboxamide. Following Lipinski's Rule of Five, N-(1,3-dioxoisoindolin-5-yl)-5-nitrobenzo[b]thiophene-2-carboxamide has 2 hydrogen bond donor(s) and 6 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 N-(1,3-dioxoisoindolin-5-yl)-5-nitrobenzo[b]thiophene-2-carboxamide?
The CAS number of N-(1,3-dioxoisoindolin-5-yl)-5-nitrobenzo[b]thiophene-2-carboxamide is 683235-53-2.
What is the molecular formula of N-(1,3-dioxoisoindolin-5-yl)-5-nitrobenzo[b]thiophene-2-carboxamide?
The molecular formula of N-(1,3-dioxoisoindolin-5-yl)-5-nitrobenzo[b]thiophene-2-carboxamide is C17H9N3O5S.
What is the molecular weight of N-(1,3-dioxoisoindolin-5-yl)-5-nitrobenzo[b]thiophene-2-carboxamide?
The molecular weight of N-(1,3-dioxoisoindolin-5-yl)-5-nitrobenzo[b]thiophene-2-carboxamide is 367.03 g/mol.
Where can I buy N-(1,3-dioxoisoindolin-5-yl)-5-nitrobenzo[b]thiophene-2-carboxamide?
You can request a quote for N-(1,3-dioxoisoindolin-5-yl)-5-nitrobenzo[b]thiophene-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,3-dioxoisoindolin-5-yl)-5-nitrobenzo[b]thiophene-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,3-dioxoisoindolin-5-yl)-5-nitrobenzo[b]thiophene-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.