![1-(1,3-Benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea structure](/static/products/7067/706772-64-7.webp)
1-(1,3-Benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea
TL;DR: 1-(1,3-Benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea (CAS 706772-64-7) is a chemical compound with molecular formula C15H15N3O4S2 and molecular weight 365.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,3-benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea
Also Known As: 1-(1,3-benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea, 4-{[(1,3-benzodioxol-5-ylcarbamothioyl)amino]methyl}benzenesulfonamide, 4-({[(2H-benzo[3,4-d]1,3-dioxolan-5-ylamino)thioxomethyl]amino}methyl)benzenes ulfonamide
| Molecular Formula | C15H15N3O4S2 |
|---|---|
| Molecular Weight | 365.05 g/mol |
| LogP | 1.5493 |
| Topological Polar Surface Area | 102.68 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 365.05038 |
| Heavy Atoms | 24 |
| Complexity | 866.78796 |
Chemical Identifiers
| CAS Number | 706772-64-7 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)NC(=S)NCC3=CC=C(C=C3)S(=O)(=O)N |
Product Overview
1-(1,3-Benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea (CAS 706772-64-7), with molecular formula C15H15N3O4S2 and molecular weight 365.05 g/mol. IUPAC: 1-(1,3-benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea.
Chemical Property Profile of 1-(1,3-Benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea
Property Insights of 1-(1,3-Benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea
The XLogP value of 1.5493 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1,3-Benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea. The TPSA of 102.68 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1,3-Benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea. Following Lipinski's Rule of Five, 1-(1,3-Benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea has 3 hydrogen bond donor(s) and 5 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 1-(1,3-Benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea?
The CAS number of 1-(1,3-Benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea is 706772-64-7.
What is the molecular formula of 1-(1,3-Benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea?
The molecular formula of 1-(1,3-Benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea is C15H15N3O4S2.
What is the molecular weight of 1-(1,3-Benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea?
The molecular weight of 1-(1,3-Benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea is 365.05 g/mol.
Where can I buy 1-(1,3-Benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea?
You can request a quote for 1-(1,3-Benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,3-Benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-Benzodioxol-5-yl)-3-[(4-sulfamoylphenyl)methyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.