1-(3-Fluorophenyl)-3-(pyridin-3-ylmethyl)urea
TL;DR: 1-(3-Fluorophenyl)-3-(pyridin-3-ylmethyl)urea (CAS 899017-57-3) is a chemical compound with molecular formula C13H12FN3O and molecular weight 245.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-fluorophenyl)-3-(pyridin-3-ylmethyl)urea
Also Known As: 1-(3-fluorophenyl)-3-(pyridin-3-ylmethyl)urea, 3-(3-fluorophenyl)-1-(pyridin-3-ylmethyl)urea, N-(3-fluorophenyl)-N'-(3-pyridinylmethyl)urea, N-(3-FLUOROPHENYL)-N'-(3-PYRIDYLMETHYL)UREA, N-(3-fluorophenyl)[(3-pyridylmethyl)amino]carboxamide
| Molecular Formula | C13H12FN3O |
|---|---|
| Molecular Weight | 245.10 g/mol |
| LogP | 2.5424 |
| Topological Polar Surface Area | 54.02 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 245.09644 |
| Heavy Atoms | 18 |
| Complexity | 530.7694 |
Chemical Identifiers
| CAS Number | 899017-57-3 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)NC(=O)NCC2=CN=CC=C2 |
Product Overview
1-(3-Fluorophenyl)-3-(pyridin-3-ylmethyl)urea (CAS 899017-57-3), with molecular formula C13H12FN3O and molecular weight 245.10 g/mol. IUPAC: 1-(3-fluorophenyl)-3-(pyridin-3-ylmethyl)urea.
Chemical Property Profile of 1-(3-Fluorophenyl)-3-(pyridin-3-ylmethyl)urea
Property Insights of 1-(3-Fluorophenyl)-3-(pyridin-3-ylmethyl)urea
The XLogP value of 2.5424 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(3-Fluorophenyl)-3-(pyridin-3-ylmethyl)urea. With a topological polar surface area (TPSA) of 54.02 Ų, 1-(3-Fluorophenyl)-3-(pyridin-3-ylmethyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(3-Fluorophenyl)-3-(pyridin-3-ylmethyl)urea has 2 hydrogen bond donor(s) and 2 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-Fluorophenyl)-3-(pyridin-3-ylmethyl)urea?
The CAS number of 1-(3-Fluorophenyl)-3-(pyridin-3-ylmethyl)urea is 899017-57-3.
What is the molecular formula of 1-(3-Fluorophenyl)-3-(pyridin-3-ylmethyl)urea?
The molecular formula of 1-(3-Fluorophenyl)-3-(pyridin-3-ylmethyl)urea is C13H12FN3O.
What is the molecular weight of 1-(3-Fluorophenyl)-3-(pyridin-3-ylmethyl)urea?
The molecular weight of 1-(3-Fluorophenyl)-3-(pyridin-3-ylmethyl)urea is 245.10 g/mol.
Where can I buy 1-(3-Fluorophenyl)-3-(pyridin-3-ylmethyl)urea?
You can request a quote for 1-(3-Fluorophenyl)-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-(3-Fluorophenyl)-3-(pyridin-3-ylmethyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Fluorophenyl)-3-(pyridin-3-ylmethyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.