1-Octadeca-9,12-dienyl-3-(3-phenylphenyl)urea
TL;DR: 1-Octadeca-9,12-dienyl-3-(3-phenylphenyl)urea (CAS 6964-85-8) is a chemical compound with molecular formula C31H44N2O and molecular weight 460.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-octadeca-9,12-dienyl-3-(3-phenylphenyl)urea
Also Known As: 1-octadeca-9,12-dienyl-3-(3-phenylphenyl)urea, 1-biphenyl-3-yl-3-octadeca-9,12-dien-1-ylurea, 1-[(9Z,12E)-octadeca-9,12-dienyl]-3-(3-phenylphenyl)urea
| Molecular Formula | C31H44N2O |
|---|---|
| Molecular Weight | 460.35 g/mol |
| LogP | 9.8 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 17 |
| Exact Mass | 460.34537 |
| Heavy Atoms | 34 |
| Complexity | 550.0 |
Chemical Identifiers
| CAS Number | 6964-85-8 |
|---|---|
| SMILES | CCCCCC=CCC=CCCCCCCCCNC(=O)NC1=CC=CC(=C1)C2=CC=CC=C2 |
| InChIKey | ZTGMUTXXQPHXHA-UHFFFAOYSA-N |
Product Overview
1-Octadeca-9,12-dienyl-3-(3-phenylphenyl)urea (CAS 6964-85-8), with molecular formula C31H44N2O and molecular weight 460.35 g/mol. IUPAC: 1-octadeca-9,12-dienyl-3-(3-phenylphenyl)urea.
Chemical Property Profile of 1-Octadeca-9,12-dienyl-3-(3-phenylphenyl)urea
Property Insights of 1-Octadeca-9,12-dienyl-3-(3-phenylphenyl)urea
The XLogP value of 9.8 indicates that 1-Octadeca-9,12-dienyl-3-(3-phenylphenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.1 Ų, 1-Octadeca-9,12-dienyl-3-(3-phenylphenyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Octadeca-9,12-dienyl-3-(3-phenylphenyl)urea has 2 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Octadeca-9,12-dienyl-3-(3-phenylphenyl)urea?
The CAS number of 1-Octadeca-9,12-dienyl-3-(3-phenylphenyl)urea is 6964-85-8.
What is the molecular formula of 1-Octadeca-9,12-dienyl-3-(3-phenylphenyl)urea?
The molecular formula of 1-Octadeca-9,12-dienyl-3-(3-phenylphenyl)urea is C31H44N2O.
What is the molecular weight of 1-Octadeca-9,12-dienyl-3-(3-phenylphenyl)urea?
The molecular weight of 1-Octadeca-9,12-dienyl-3-(3-phenylphenyl)urea is 460.35 g/mol.
Where can I buy 1-Octadeca-9,12-dienyl-3-(3-phenylphenyl)urea?
You can request a quote for 1-Octadeca-9,12-dienyl-3-(3-phenylphenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Octadeca-9,12-dienyl-3-(3-phenylphenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-Octadeca-9,12-dienyl-3-(3-phenylphenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.