![1-[3-(4-Bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea structure](/static/products/5128/512817-46-8.webp)
1-[3-(4-Bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea
TL;DR: 1-[3-(4-Bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea (CAS 512817-46-8) is a chemical compound with molecular formula C11H18BrN5OS and molecular weight 347.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea
Also Known As: 1-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea, 2-[3-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)propanoyl]-N-ethylhydrazinecarbothioamide, 1-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propanoylamino]-3-ethyl-thiourea, 2-[3-(4-BROMO-3,5-DIMETHYL-1H-PYRAZOL-1-YL)PROPANOYL]-N-ETHYL-1-HYDRAZINECARBOTHIOAMIDE
| Molecular Formula | C11H18BrN5OS |
|---|---|
| Molecular Weight | 347.04 g/mol |
| LogP | 1.16774 |
| Topological Polar Surface Area | 70.98 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 347.04153 |
| Heavy Atoms | 19 |
| Complexity | 473.89575 |
Chemical Identifiers
| CAS Number | 512817-46-8 |
|---|---|
| SMILES | CCNC(=S)NNC(=O)CCN1C(=C(C(=N1)C)Br)C |
Product Overview
1-[3-(4-Bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea (CAS 512817-46-8), with molecular formula C11H18BrN5OS and molecular weight 347.04 g/mol. IUPAC: 1-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea.
Chemical Property Profile of 1-[3-(4-Bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea
Property Insights of 1-[3-(4-Bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea
The XLogP value of 1.16774 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[3-(4-Bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea. The TPSA of 70.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[3-(4-Bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea. Following Lipinski's Rule of Five, 1-[3-(4-Bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea 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-[3-(4-Bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea?
The CAS number of 1-[3-(4-Bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea is 512817-46-8.
What is the molecular formula of 1-[3-(4-Bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea?
The molecular formula of 1-[3-(4-Bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea is C11H18BrN5OS.
What is the molecular weight of 1-[3-(4-Bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea?
The molecular weight of 1-[3-(4-Bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea is 347.04 g/mol.
Where can I buy 1-[3-(4-Bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea?
You can request a quote for 1-[3-(4-Bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3-(4-Bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[3-(4-Bromo-3,5-dimethylpyrazol-1-yl)propanoylamino]-3-ethylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.