1-Nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea
TL;DR: 1-Nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea (CAS 58550-48-4) is a chemical compound with molecular formula C13H12N4O2 and molecular weight 256.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea
Also Known As: 1-nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea, N-Nitroso-N-phenyl-N'-[(pyridin-3-yl)methyl]urea, Urea, N-nitroso-N-phenyl-N'-(3-pyridinylmethyl)-
| Molecular Formula | C13H12N4O2 |
|---|---|
| Molecular Weight | 256.10 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 74.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.09604 |
| Heavy Atoms | 19 |
| Complexity | 305.0 |
Chemical Identifiers
| CAS Number | 58550-48-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)N(C(=O)NCC2=CN=CC=C2)N=O |
| InChIKey | UQFDTLSVHXYXLP-UHFFFAOYSA-N |
Product Overview
1-Nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea (CAS 58550-48-4), with molecular formula C13H12N4O2 and molecular weight 256.10 g/mol. IUPAC: 1-nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea.
Chemical Property Profile of 1-Nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea
Property Insights of 1-Nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea. The TPSA of 74.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea. Following Lipinski's Rule of Five, 1-Nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea has 1 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-Nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea?
The CAS number of 1-Nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea is 58550-48-4.
What is the molecular formula of 1-Nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea?
The molecular formula of 1-Nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea is C13H12N4O2.
What is the molecular weight of 1-Nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea?
The molecular weight of 1-Nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea is 256.10 g/mol.
Where can I buy 1-Nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea?
You can request a quote for 1-Nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-Nitroso-1-phenyl-3-(pyridin-3-ylmethyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.