![1-(1,3-Benzodioxol-5-yl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea structure](/static/products/7082/708241-39-8.webp)
1-(1,3-Benzodioxol-5-yl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea
TL;DR: 1-(1,3-Benzodioxol-5-yl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea (CAS 708241-39-8) is a chemical compound with molecular formula C21H19N3O4S2 and molecular weight 441.08 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-[(4-methylphenyl)sulfonylamino]phenyl]thiourea
Also Known As: 1-(1,3-benzodioxol-5-yl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea, N-{4-[(1,3-benzodioxol-5-ylcarbamothioyl)amino]phenyl}-4-methylbenzenesulfonamide, (4-{[(2H-benzo[3,4-d]1,3-dioxolan-5-ylamino)thioxomethyl]amino}phenyl)[(4-meth ylphenyl)sulfonyl]amine
| Molecular Formula | C21H19N3O4S2 |
|---|---|
| Molecular Weight | 441.08 g/mol |
| LogP | 4.33342 |
| Topological Polar Surface Area | 88.69 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 441.0817 |
| Heavy Atoms | 30 |
| Complexity | 1177.8783 |
Chemical Identifiers
| CAS Number | 708241-39-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)NC(=S)NC3=CC4=C(C=C3)OCO4 |
Product Overview
1-(1,3-Benzodioxol-5-yl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea (CAS 708241-39-8), with molecular formula C21H19N3O4S2 and molecular weight 441.08 g/mol. IUPAC: 1-(1,3-benzodioxol-5-yl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea.
Chemical Property Profile of 1-(1,3-Benzodioxol-5-yl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea
Property Insights of 1-(1,3-Benzodioxol-5-yl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea
The XLogP value of 4.33342 indicates that 1-(1,3-Benzodioxol-5-yl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.69 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1,3-Benzodioxol-5-yl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea. Following Lipinski's Rule of Five, 1-(1,3-Benzodioxol-5-yl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]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-[(4-methylphenyl)sulfonylamino]phenyl]thiourea?
The CAS number of 1-(1,3-Benzodioxol-5-yl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea is 708241-39-8.
What is the molecular formula of 1-(1,3-Benzodioxol-5-yl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea?
The molecular formula of 1-(1,3-Benzodioxol-5-yl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea is C21H19N3O4S2.
What is the molecular weight of 1-(1,3-Benzodioxol-5-yl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea?
The molecular weight of 1-(1,3-Benzodioxol-5-yl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea is 441.08 g/mol.
Where can I buy 1-(1,3-Benzodioxol-5-yl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea?
You can request a quote for 1-(1,3-Benzodioxol-5-yl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]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-[(4-methylphenyl)sulfonylamino]phenyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-Benzodioxol-5-yl)-3-[4-[(4-methylphenyl)sulfonylamino]phenyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.