![1-[(4-Nitrobenzoyl)amino]-3-propan-2-ylthiourea structure](/static/products/170/17050-15-6.png)
1-[(4-Nitrobenzoyl)amino]-3-propan-2-ylthiourea
TL;DR: 1-[(4-Nitrobenzoyl)amino]-3-propan-2-ylthiourea (CAS 17050-15-6) is a chemical compound with molecular formula C11H14N4O3S and molecular weight 282.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-nitrobenzoyl)amino]-3-propan-2-ylthiourea
Also Known As: 4-isopropyl-1-(4-nitro-benzoyl)-thiosemicarbazide, 1-[(4-nitrobenzoyl)amino]-3-propan-2-ylthiourea
| Molecular Formula | C11H14N4O3S |
|---|---|
| Molecular Weight | 282.08 g/mol |
| LogP | 1.1121 |
| Topological Polar Surface Area | 96.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.07867 |
| Heavy Atoms | 19 |
| Complexity | 487.2186 |
Chemical Identifiers
| CAS Number | 17050-15-6 |
|---|---|
| SMILES | CC(C)NC(=S)NNC(=O)C1=CC=C(C=C1)[N+](=O)[O-] |
Product Overview
1-[(4-Nitrobenzoyl)amino]-3-propan-2-ylthiourea (CAS 17050-15-6), with molecular formula C11H14N4O3S and molecular weight 282.08 g/mol. IUPAC: 1-[(4-nitrobenzoyl)amino]-3-propan-2-ylthiourea.
Chemical Property Profile of 1-[(4-Nitrobenzoyl)amino]-3-propan-2-ylthiourea
Property Insights of 1-[(4-Nitrobenzoyl)amino]-3-propan-2-ylthiourea
The XLogP value of 1.1121 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[(4-Nitrobenzoyl)amino]-3-propan-2-ylthiourea. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[(4-Nitrobenzoyl)amino]-3-propan-2-ylthiourea. Following Lipinski's Rule of Five, 1-[(4-Nitrobenzoyl)amino]-3-propan-2-ylthiourea 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-Nitrobenzoyl)amino]-3-propan-2-ylthiourea?
The CAS number of 1-[(4-Nitrobenzoyl)amino]-3-propan-2-ylthiourea is 17050-15-6.
What is the molecular formula of 1-[(4-Nitrobenzoyl)amino]-3-propan-2-ylthiourea?
The molecular formula of 1-[(4-Nitrobenzoyl)amino]-3-propan-2-ylthiourea is C11H14N4O3S.
What is the molecular weight of 1-[(4-Nitrobenzoyl)amino]-3-propan-2-ylthiourea?
The molecular weight of 1-[(4-Nitrobenzoyl)amino]-3-propan-2-ylthiourea is 282.08 g/mol.
Where can I buy 1-[(4-Nitrobenzoyl)amino]-3-propan-2-ylthiourea?
You can request a quote for 1-[(4-Nitrobenzoyl)amino]-3-propan-2-ylthiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(4-Nitrobenzoyl)amino]-3-propan-2-ylthiourea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(4-Nitrobenzoyl)amino]-3-propan-2-ylthiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.