1-(2,4-Dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea
TL;DR: 1-(2,4-Dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea (CAS 701925-08-8) is a chemical compound with molecular formula C20H20N4O3S and molecular weight 396.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea
Also Known As: 1-(2,4-dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea, N-({[(2,4-dimethoxyphenyl)amino]thioxomethyl}amino)(2-pyrrolylphenyl)carboxami de, N-(2,4-dimethoxyphenyl)-2-{[2-(1H-pyrrol-1-yl)phenyl]carbonyl}hydrazinecarbothioamide
| Molecular Formula | C20H20N4O3S |
|---|---|
| Molecular Weight | 396.13 g/mol |
| LogP | 3.1259 |
| Topological Polar Surface Area | 76.55 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 396.1256 |
| Heavy Atoms | 28 |
| Complexity | 973.342 |
Chemical Identifiers
| CAS Number | 701925-08-8 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)NC(=S)NNC(=O)C2=CC=CC=C2N3C=CC=C3)OC |
Product Overview
1-(2,4-Dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea (CAS 701925-08-8), with molecular formula C20H20N4O3S and molecular weight 396.13 g/mol. IUPAC: 1-(2,4-dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea.
Chemical Property Profile of 1-(2,4-Dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea
Property Insights of 1-(2,4-Dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea
The XLogP value of 3.1259 indicates that 1-(2,4-Dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,4-Dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea. Following Lipinski's Rule of Five, 1-(2,4-Dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea has 3 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-(2,4-Dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea?
The CAS number of 1-(2,4-Dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea is 701925-08-8.
What is the molecular formula of 1-(2,4-Dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea?
The molecular formula of 1-(2,4-Dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea is C20H20N4O3S.
What is the molecular weight of 1-(2,4-Dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea?
The molecular weight of 1-(2,4-Dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea is 396.13 g/mol.
Where can I buy 1-(2,4-Dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea?
You can request a quote for 1-(2,4-Dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)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-(2,4-Dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,4-Dimethoxyphenyl)-3-[(2-pyrrol-1-ylbenzoyl)amino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.