1-(1,3-Benzodioxol-5-yl)-3-[(5-propylthiophene-3-carbonyl)amino]thiourea
TL;DR: 1-(1,3-Benzodioxol-5-yl)-3-[(5-propylthiophene-3-carbonyl)amino]thiourea (CAS 701951-32-8) is a chemical compound with molecular formula C16H17N3O3S2 and molecular weight 363.07 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-[(5-propylthiophene-3-carbonyl)amino]thiourea
Also Known As: 1-(1,3-benzodioxol-5-yl)-3-[(5-propylthiophene-3-carbonyl)amino]thiourea, N-(1,3-benzodioxol-5-yl)-2-[(5-propylthiophen-3-yl)carbonyl]hydrazinecarbothioamide, N-{[(2H-benzo[3,4-d]1,3-dioxolan-5-ylamino)thioxomethyl]amino}(5-propyl(3-thie nyl))carboxamide
| Molecular Formula | C16H17N3O3S2 |
|---|---|
| Molecular Weight | 363.07 g/mol |
| LogP | 3.0607 |
| Topological Polar Surface Area | 71.62 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 363.07114 |
| Heavy Atoms | 24 |
| Complexity | 760.77594 |
Chemical Identifiers
| CAS Number | 701951-32-8 |
|---|---|
| SMILES | CCCC1=CC(=CS1)C(=O)NNC(=S)NC2=CC3=C(C=C2)OCO3 |
Product Overview
1-(1,3-Benzodioxol-5-yl)-3-[(5-propylthiophene-3-carbonyl)amino]thiourea (CAS 701951-32-8), with molecular formula C16H17N3O3S2 and molecular weight 363.07 g/mol. IUPAC: 1-(1,3-benzodioxol-5-yl)-3-[(5-propylthiophene-3-carbonyl)amino]thiourea.
Chemical Property Profile of 1-(1,3-Benzodioxol-5-yl)-3-[(5-propylthiophene-3-carbonyl)amino]thiourea
Property Insights of 1-(1,3-Benzodioxol-5-yl)-3-[(5-propylthiophene-3-carbonyl)amino]thiourea
The XLogP value of 3.0607 indicates that 1-(1,3-Benzodioxol-5-yl)-3-[(5-propylthiophene-3-carbonyl)amino]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.62 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1,3-Benzodioxol-5-yl)-3-[(5-propylthiophene-3-carbonyl)amino]thiourea. Following Lipinski's Rule of Five, 1-(1,3-Benzodioxol-5-yl)-3-[(5-propylthiophene-3-carbonyl)amino]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-[(5-propylthiophene-3-carbonyl)amino]thiourea?
The CAS number of 1-(1,3-Benzodioxol-5-yl)-3-[(5-propylthiophene-3-carbonyl)amino]thiourea is 701951-32-8.
What is the molecular formula of 1-(1,3-Benzodioxol-5-yl)-3-[(5-propylthiophene-3-carbonyl)amino]thiourea?
The molecular formula of 1-(1,3-Benzodioxol-5-yl)-3-[(5-propylthiophene-3-carbonyl)amino]thiourea is C16H17N3O3S2.
What is the molecular weight of 1-(1,3-Benzodioxol-5-yl)-3-[(5-propylthiophene-3-carbonyl)amino]thiourea?
The molecular weight of 1-(1,3-Benzodioxol-5-yl)-3-[(5-propylthiophene-3-carbonyl)amino]thiourea is 363.07 g/mol.
Where can I buy 1-(1,3-Benzodioxol-5-yl)-3-[(5-propylthiophene-3-carbonyl)amino]thiourea?
You can request a quote for 1-(1,3-Benzodioxol-5-yl)-3-[(5-propylthiophene-3-carbonyl)amino]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-[(5-propylthiophene-3-carbonyl)amino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,3-Benzodioxol-5-yl)-3-[(5-propylthiophene-3-carbonyl)amino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.