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N-[(4-sulfamoylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide
TL;DR: N-[(4-sulfamoylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide (CAS 708292-61-9) is a chemical compound with molecular formula C15H13N3O5S2 and molecular weight 379.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-sulfamoylphenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide
Also Known As: N-[(4-sulfamoylphenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide, AP-970/42769227, N-[(4-sulfamoylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide, N-[(4-sulfamoylphenyl)thiocarbamoyl]-piperonylamide, N-({[4-(aminosulfonyl)phenyl]amino}carbonothioyl)-1,3-benzodioxole-5-carboxamide
| Molecular Formula | C15H13N3O5S2 |
|---|---|
| Molecular Weight | 379.03 g/mol |
| LogP | 1.1895 |
| Topological Polar Surface Area | 119.75 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 379.02966 |
| Heavy Atoms | 25 |
| Complexity | 942.1392 |
Chemical Identifiers
| CAS Number | 708292-61-9 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)C(=O)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)N |
Product Overview
N-[(4-sulfamoylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide (CAS 708292-61-9), with molecular formula C15H13N3O5S2 and molecular weight 379.03 g/mol. IUPAC: N-[(4-sulfamoylphenyl)carbamothioyl]-1,3-benzodioxole-5-carboxamide.
Chemical Property Profile of N-[(4-sulfamoylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide
Property Insights of N-[(4-sulfamoylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide
The XLogP value of 1.1895 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(4-sulfamoylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide. The TPSA of 119.75 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(4-sulfamoylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide. Following Lipinski's Rule of Five, N-[(4-sulfamoylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide has 3 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-[(4-sulfamoylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide?
The CAS number of N-[(4-sulfamoylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide is 708292-61-9.
What is the molecular formula of N-[(4-sulfamoylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide?
The molecular formula of N-[(4-sulfamoylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide is C15H13N3O5S2.
What is the molecular weight of N-[(4-sulfamoylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide?
The molecular weight of N-[(4-sulfamoylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide is 379.03 g/mol.
Where can I buy N-[(4-sulfamoylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide?
You can request a quote for N-[(4-sulfamoylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4-sulfamoylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-sulfamoylanilino)-sulfanylidenemethyl]-1,3-benzodioxole-5-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.