![1-Butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]thiourea structure](/static/products/7168/7168-03-8.webp)
1-Butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]thiourea
TL;DR: 1-Butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]thiourea (CAS 7168-03-8) is a chemical compound with molecular formula C11H18ClN5OS and molecular weight 303.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]thiourea
Also Known As: 1-butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]thiourea, N-(sec-butyl)-2-[3-(4-chloro-1H-pyrazol-1-yl)propanoyl]hydrazinecarbothioamide, N-(Butan-2-yl)-2-[3-(4-chloro-1H-pyrazol-1-yl)propanoyl]hydrazine-1-carbothioamide, N-(butan-2-yl)-2-[3-(4-chloro-1H-pyrazol-1-yl)propanoyl]hydrazinecarbothioamide, N-(SEC-BUTYL)-2-[3-(4-CHLORO-1H-PYRAZOL-1-YL)PROPANOYL]-1-HYDRAZINECARBOTHIOAMIDE
| Molecular Formula | C11H18ClN5OS |
|---|---|
| Molecular Weight | 303.09 g/mol |
| LogP | 1.2204 |
| Topological Polar Surface Area | 70.98 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 303.09207 |
| Heavy Atoms | 19 |
| Complexity | 436.47498 |
Chemical Identifiers
| CAS Number | 7168-03-8 |
|---|---|
| SMILES | CCC(C)NC(=S)NNC(=O)CCN1C=C(C=N1)Cl |
Product Overview
1-Butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]thiourea (CAS 7168-03-8), with molecular formula C11H18ClN5OS and molecular weight 303.09 g/mol. IUPAC: 1-butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]thiourea.
Chemical Property Profile of 1-Butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]thiourea
Property Insights of 1-Butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]thiourea
The XLogP value of 1.2204 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]thiourea. The TPSA of 70.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]thiourea. Following Lipinski's Rule of Five, 1-Butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]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-Butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]thiourea?
The CAS number of 1-Butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]thiourea is 7168-03-8.
What is the molecular formula of 1-Butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]thiourea?
The molecular formula of 1-Butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]thiourea is C11H18ClN5OS.
What is the molecular weight of 1-Butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]thiourea?
The molecular weight of 1-Butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]thiourea is 303.09 g/mol.
Where can I buy 1-Butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]thiourea?
You can request a quote for 1-Butan-2-yl-3-[3-(4-chloropyrazol-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-Butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-Butan-2-yl-3-[3-(4-chloropyrazol-1-yl)propanoylamino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.