1-(1-Benzothiophene-3-carbonylamino)-3-(3-methylphenyl)thiourea
TL;DR: 1-(1-Benzothiophene-3-carbonylamino)-3-(3-methylphenyl)thiourea (CAS 438233-79-5) is a chemical compound with molecular formula C17H15N3OS2 and molecular weight 341.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-benzothiophene-3-carbonylamino)-3-(3-methylphenyl)thiourea
Also Known As: 1-(1-benzothiophene-3-carbonylamino)-3-(3-methylphenyl)thiourea, 2-(1-benzothien-3-ylcarbonyl)-N-(3-methylphenyl)hydrazinecarbothioamide, 2-(1-benzothiophen-3-ylcarbonyl)-N-(3-methylphenyl)hydrazinecarbothioamide, benzo[b]thiophen-3-yl-N-({[(3-methylphenyl)amino]thioxomethyl}amino)carboxamid e
| Molecular Formula | C17H15N3OS2 |
|---|---|
| Molecular Weight | 341.07 g/mol |
| LogP | 3.84112 |
| Topological Polar Surface Area | 53.16 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 341.06564 |
| Heavy Atoms | 23 |
| Complexity | 872.9108 |
Chemical Identifiers
| CAS Number | 438233-79-5 |
|---|---|
| SMILES | CC1=CC(=CC=C1)NC(=S)NNC(=O)C2=CSC3=CC=CC=C32 |
Product Overview
1-(1-Benzothiophene-3-carbonylamino)-3-(3-methylphenyl)thiourea (CAS 438233-79-5), with molecular formula C17H15N3OS2 and molecular weight 341.07 g/mol. IUPAC: 1-(1-benzothiophene-3-carbonylamino)-3-(3-methylphenyl)thiourea.
Chemical Property Profile of 1-(1-Benzothiophene-3-carbonylamino)-3-(3-methylphenyl)thiourea
Property Insights of 1-(1-Benzothiophene-3-carbonylamino)-3-(3-methylphenyl)thiourea
The XLogP value of 3.84112 indicates that 1-(1-Benzothiophene-3-carbonylamino)-3-(3-methylphenyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.16 Ų, 1-(1-Benzothiophene-3-carbonylamino)-3-(3-methylphenyl)thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-Benzothiophene-3-carbonylamino)-3-(3-methylphenyl)thiourea has 3 hydrogen bond donor(s) and 3 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-Benzothiophene-3-carbonylamino)-3-(3-methylphenyl)thiourea?
The CAS number of 1-(1-Benzothiophene-3-carbonylamino)-3-(3-methylphenyl)thiourea is 438233-79-5.
What is the molecular formula of 1-(1-Benzothiophene-3-carbonylamino)-3-(3-methylphenyl)thiourea?
The molecular formula of 1-(1-Benzothiophene-3-carbonylamino)-3-(3-methylphenyl)thiourea is C17H15N3OS2.
What is the molecular weight of 1-(1-Benzothiophene-3-carbonylamino)-3-(3-methylphenyl)thiourea?
The molecular weight of 1-(1-Benzothiophene-3-carbonylamino)-3-(3-methylphenyl)thiourea is 341.07 g/mol.
Where can I buy 1-(1-Benzothiophene-3-carbonylamino)-3-(3-methylphenyl)thiourea?
You can request a quote for 1-(1-Benzothiophene-3-carbonylamino)-3-(3-methylphenyl)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-Benzothiophene-3-carbonylamino)-3-(3-methylphenyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-Benzothiophene-3-carbonylamino)-3-(3-methylphenyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.