![1-(3-Ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea structure](/static/products/1005/1005594-67-1.webp)
1-(3-Ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea
TL;DR: 1-(3-Ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea (CAS 1005594-67-1) is a chemical compound with molecular formula C17H22N6O4S and molecular weight 406.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea
Also Known As: 1-(3-ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea, N-(3-ethoxypropyl)-2-({4-[(4-nitro-1H-pyrazol-1-yl)methyl]phenyl}carbonyl)hydrazinecarbothioamide, N~1~-(3-ETHOXYPROPYL)-2-{4-[(4-NITRO-1H-PYRAZOL-1-YL)METHYL]BENZOYL}-1-HYDRAZINECARBOTHIOAMIDE
| Molecular Formula | C17H22N6O4S |
|---|---|
| Molecular Weight | 406.14 g/mol |
| LogP | 1.3751 |
| Topological Polar Surface Area | 123.35 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 406.14233 |
| Heavy Atoms | 28 |
| Complexity | 808.2339 |
Chemical Identifiers
| CAS Number | 1005594-67-1 |
|---|---|
| SMILES | CCOCCCNC(=S)NNC(=O)C1=CC=C(C=C1)CN2C=C(C=N2)[N+](=O)[O-] |
Product Overview
1-(3-Ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea (CAS 1005594-67-1), with molecular formula C17H22N6O4S and molecular weight 406.14 g/mol. IUPAC: 1-(3-ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea.
Chemical Property Profile of 1-(3-Ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea
Property Insights of 1-(3-Ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea
The XLogP value of 1.3751 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea. The TPSA of 123.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea. Following Lipinski's Rule of Five, 1-(3-Ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]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-(3-Ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea?
The CAS number of 1-(3-Ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea is 1005594-67-1.
What is the molecular formula of 1-(3-Ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea?
The molecular formula of 1-(3-Ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea is C17H22N6O4S.
What is the molecular weight of 1-(3-Ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea?
The molecular weight of 1-(3-Ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea is 406.14 g/mol.
Where can I buy 1-(3-Ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea?
You can request a quote for 1-(3-Ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]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-(3-Ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Ethoxypropyl)-3-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.