![1-[(4-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea structure](/static/products/894/894373-35-4.png)
1-[(4-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea
TL;DR: 1-[(4-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea (CAS 894373-35-4) is a chemical compound with molecular formula C15H17ClN6O4S and molecular weight 412.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea
Also Known As: 1-[(4-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea, N-(4-chlorobenzyl)-2-[2-(3-methoxy-4-nitro-1H-pyrazol-1-yl)propanoyl]hydrazinecarbothioamide, N-[({[(4-chlorophenyl)methyl]amino}thioxomethyl)amino]-2-(3-methoxy-4-nitropyr azolyl)propanamide
| Molecular Formula | C15H17ClN6O4S |
|---|---|
| Molecular Weight | 412.07 g/mol |
| LogP | 1.7098 |
| Topological Polar Surface Area | 123.35 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 412.07205 |
| Heavy Atoms | 27 |
| Complexity | 841.3327 |
Chemical Identifiers
| CAS Number | 894373-35-4 |
|---|---|
| SMILES | CC(C(=O)NNC(=S)NCC1=CC=C(C=C1)Cl)N2C=C(C(=N2)OC)[N+](=O)[O-] |
Product Overview
1-[(4-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea (CAS 894373-35-4), with molecular formula C15H17ClN6O4S and molecular weight 412.07 g/mol. IUPAC: 1-[(4-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea.
Chemical Property Profile of 1-[(4-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea
Property Insights of 1-[(4-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea
The XLogP value of 1.7098 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(4-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea. The TPSA of 123.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(4-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea. Following Lipinski's Rule of Five, 1-[(4-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea has 3 hydrogen bond donor(s) and 6 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-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea?
The CAS number of 1-[(4-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea is 894373-35-4.
What is the molecular formula of 1-[(4-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea?
The molecular formula of 1-[(4-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea is C15H17ClN6O4S.
What is the molecular weight of 1-[(4-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea?
The molecular weight of 1-[(4-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea is 412.07 g/mol.
Where can I buy 1-[(4-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea?
You can request a quote for 1-[(4-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]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-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-chlorophenyl)methyl]-3-[2-(3-methoxy-4-nitropyrazol-1-yl)propanoylamino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.