1-Isopropyl-1-nitroso-3-phenylurea
TL;DR: 1-Isopropyl-1-nitroso-3-phenylurea (CAS 78326-57-5) is a chemical compound with molecular formula C10H13N3O2 and molecular weight 207.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-nitroso-3-phenyl-1-propan-2-ylurea
Also Known As: 1-Isopropyl-1-nitroso-3-phenylurea, 1-nitroso-3-phenyl-1-propan-2-ylurea, 1-Isopropyl-3-phenyl-1-nitrosourea, Urea, N-(1-methylethyl)-N-nitroso-N'-phenyl-, 3-nitroso-1-phenyl-3-(propan-2-yl)urea
| Molecular Formula | C10H13N3O2 |
|---|---|
| Molecular Weight | 207.10 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.10077 |
| Heavy Atoms | 15 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 78326-57-5 |
|---|---|
| SMILES | CC(C)N(C(=O)NC1=CC=CC=C1)N=O |
| InChIKey | VBIPNWLRLREJNA-UHFFFAOYSA-N |
Product Overview
1-Isopropyl-1-nitroso-3-phenylurea (CAS 78326-57-5), with molecular formula C10H13N3O2 and molecular weight 207.10 g/mol. IUPAC: 1-nitroso-3-phenyl-1-propan-2-ylurea.
Chemical Property Profile of 1-Isopropyl-1-nitroso-3-phenylurea
Property Insights of 1-Isopropyl-1-nitroso-3-phenylurea
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Isopropyl-1-nitroso-3-phenylurea. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Isopropyl-1-nitroso-3-phenylurea. Following Lipinski's Rule of Five, 1-Isopropyl-1-nitroso-3-phenylurea has 1 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-Isopropyl-1-nitroso-3-phenylurea?
The CAS number of 1-Isopropyl-1-nitroso-3-phenylurea is 78326-57-5.
What is the molecular formula of 1-Isopropyl-1-nitroso-3-phenylurea?
The molecular formula of 1-Isopropyl-1-nitroso-3-phenylurea is C10H13N3O2.
What is the molecular weight of 1-Isopropyl-1-nitroso-3-phenylurea?
The molecular weight of 1-Isopropyl-1-nitroso-3-phenylurea is 207.10 g/mol.
Where can I buy 1-Isopropyl-1-nitroso-3-phenylurea?
You can request a quote for 1-Isopropyl-1-nitroso-3-phenylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Isopropyl-1-nitroso-3-phenylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-Isopropyl-1-nitroso-3-phenylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.