1-(3-Methoxyphenyl)-3-(thiophene-2-carbonyl)thiourea
TL;DR: 1-(3-Methoxyphenyl)-3-(thiophene-2-carbonyl)thiourea (CAS 6127-83-9) is a chemical compound with molecular formula C13H12N2O2S2 and molecular weight 292.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-methoxyphenyl)carbamothioyl]thiophene-2-carboxamide
Also Known As: BIM-0015406.P001, n-[(3-methoxyphenyl)carbamothioyl]thiophene-2-carboxamide, 1-(3-METHOXYPHENYL)-3-(THIOPHENE-2-CARBONYL)THIOUREA, N-{[(3-methoxyphenyl)amino]carbonothioyl}-2-thiophenecarboxamide
| Molecular Formula | C13H12N2O2S2 |
|---|---|
| Molecular Weight | 292.03 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 292.03403 |
| Heavy Atoms | 19 |
| Complexity | 339.0 |
Chemical Identifiers
| CAS Number | 6127-83-9 |
|---|---|
| SMILES | COC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC=CS2 |
| InChIKey | VHUARKRTSSNKBD-UHFFFAOYSA-N |
Product Overview
1-(3-Methoxyphenyl)-3-(thiophene-2-carbonyl)thiourea (CAS 6127-83-9), with molecular formula C13H12N2O2S2 and molecular weight 292.03 g/mol. IUPAC: N-[(3-methoxyphenyl)carbamothioyl]thiophene-2-carboxamide.
Chemical Property Profile of 1-(3-Methoxyphenyl)-3-(thiophene-2-carbonyl)thiourea
Property Insights of 1-(3-Methoxyphenyl)-3-(thiophene-2-carbonyl)thiourea
The XLogP value of 3.5 indicates that 1-(3-Methoxyphenyl)-3-(thiophene-2-carbonyl)thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Methoxyphenyl)-3-(thiophene-2-carbonyl)thiourea. Following Lipinski's Rule of Five, 1-(3-Methoxyphenyl)-3-(thiophene-2-carbonyl)thiourea has 2 hydrogen bond donor(s) and 4 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-(3-Methoxyphenyl)-3-(thiophene-2-carbonyl)thiourea?
The CAS number of 1-(3-Methoxyphenyl)-3-(thiophene-2-carbonyl)thiourea is 6127-83-9.
What is the molecular formula of 1-(3-Methoxyphenyl)-3-(thiophene-2-carbonyl)thiourea?
The molecular formula of 1-(3-Methoxyphenyl)-3-(thiophene-2-carbonyl)thiourea is C13H12N2O2S2.
What is the molecular weight of 1-(3-Methoxyphenyl)-3-(thiophene-2-carbonyl)thiourea?
The molecular weight of 1-(3-Methoxyphenyl)-3-(thiophene-2-carbonyl)thiourea is 292.03 g/mol.
Where can I buy 1-(3-Methoxyphenyl)-3-(thiophene-2-carbonyl)thiourea?
You can request a quote for 1-(3-Methoxyphenyl)-3-(thiophene-2-carbonyl)thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Methoxyphenyl)-3-(thiophene-2-carbonyl)thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Methoxyphenyl)-3-(thiophene-2-carbonyl)thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.