![1-(4-Methyl-2-oxochromen-7-yl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea structure](/static/products/7019/701950-82-5.webp)
1-(4-Methyl-2-oxochromen-7-yl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea
TL;DR: 1-(4-Methyl-2-oxochromen-7-yl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea (CAS 701950-82-5) is a chemical compound with molecular formula C22H18N4O3S and molecular weight 418.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methyl-2-oxochromen-7-yl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea
Also Known As: 1-(4-methyl-2-oxochromen-7-yl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea, N-({[(4-methyl-2-oxochromen-7-yl)amino]thioxomethyl}amino)(4-pyrrolylphenyl)ca rboxamide, N-(4-methyl-2-oxo-2H-chromen-7-yl)-2-{[4-(1H-pyrrol-1-yl)phenyl]carbonyl}hydrazinecarbothioamide
| Molecular Formula | C22H18N4O3S |
|---|---|
| Molecular Weight | 418.11 g/mol |
| LogP | 3.52352 |
| Topological Polar Surface Area | 88.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 418.10995 |
| Heavy Atoms | 30 |
| Complexity | 1278.2391 |
Chemical Identifiers
| CAS Number | 701950-82-5 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C1C=CC(=C2)NC(=S)NNC(=O)C3=CC=C(C=C3)N4C=CC=C4 |
Product Overview
1-(4-Methyl-2-oxochromen-7-yl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea (CAS 701950-82-5), with molecular formula C22H18N4O3S and molecular weight 418.11 g/mol. IUPAC: 1-(4-methyl-2-oxochromen-7-yl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea.
Chemical Property Profile of 1-(4-Methyl-2-oxochromen-7-yl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea
Property Insights of 1-(4-Methyl-2-oxochromen-7-yl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea
The XLogP value of 3.52352 indicates that 1-(4-Methyl-2-oxochromen-7-yl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Methyl-2-oxochromen-7-yl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea. Following Lipinski's Rule of Five, 1-(4-Methyl-2-oxochromen-7-yl)-3-[(4-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-(4-Methyl-2-oxochromen-7-yl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea?
The CAS number of 1-(4-Methyl-2-oxochromen-7-yl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea is 701950-82-5.
What is the molecular formula of 1-(4-Methyl-2-oxochromen-7-yl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea?
The molecular formula of 1-(4-Methyl-2-oxochromen-7-yl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea is C22H18N4O3S.
What is the molecular weight of 1-(4-Methyl-2-oxochromen-7-yl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea?
The molecular weight of 1-(4-Methyl-2-oxochromen-7-yl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea is 418.11 g/mol.
Where can I buy 1-(4-Methyl-2-oxochromen-7-yl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea?
You can request a quote for 1-(4-Methyl-2-oxochromen-7-yl)-3-[(4-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-(4-Methyl-2-oxochromen-7-yl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methyl-2-oxochromen-7-yl)-3-[(4-pyrrol-1-ylbenzoyl)amino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.