![1-[3,5-Bis(trifluoromethyl)phenyl]-3-propylurea structure](/static/products/2375/23751-81-7.webp)
1-[3,5-Bis(trifluoromethyl)phenyl]-3-propylurea
TL;DR: 1-[3,5-Bis(trifluoromethyl)phenyl]-3-propylurea (CAS 23751-81-7) is a chemical compound with molecular formula C12H12F6N2O and molecular weight 314.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3,5-bis(trifluoromethyl)phenyl]-3-propylurea
Also Known As: 1-[3,5-bis(trifluoromethyl)phenyl]-3-propylurea, N-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)(PROPYLAMINO)FORMAMIDE, 1-[3,5-bis(trifluoromethyl)phenyl]-3-propyl-urea, C12H12F6N2O
| Molecular Formula | C12H12F6N2O |
|---|---|
| Molecular Weight | 314.09 g/mol |
| LogP | 4.2557 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 314.0854 |
| Heavy Atoms | 21 |
| Complexity | 477.19962 |
Chemical Identifiers
| CAS Number | 23751-81-7 |
|---|---|
| SMILES | CCCNC(=O)NC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F |
Product Overview
1-[3,5-Bis(trifluoromethyl)phenyl]-3-propylurea (CAS 23751-81-7), with molecular formula C12H12F6N2O and molecular weight 314.09 g/mol. IUPAC: 1-[3,5-bis(trifluoromethyl)phenyl]-3-propylurea.
Chemical Property Profile of 1-[3,5-Bis(trifluoromethyl)phenyl]-3-propylurea
Property Insights of 1-[3,5-Bis(trifluoromethyl)phenyl]-3-propylurea
The XLogP value of 4.2557 indicates that 1-[3,5-Bis(trifluoromethyl)phenyl]-3-propylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, 1-[3,5-Bis(trifluoromethyl)phenyl]-3-propylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[3,5-Bis(trifluoromethyl)phenyl]-3-propylurea has 2 hydrogen bond donor(s) and 1 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-[3,5-Bis(trifluoromethyl)phenyl]-3-propylurea?
The CAS number of 1-[3,5-Bis(trifluoromethyl)phenyl]-3-propylurea is 23751-81-7.
What is the molecular formula of 1-[3,5-Bis(trifluoromethyl)phenyl]-3-propylurea?
The molecular formula of 1-[3,5-Bis(trifluoromethyl)phenyl]-3-propylurea is C12H12F6N2O.
What is the molecular weight of 1-[3,5-Bis(trifluoromethyl)phenyl]-3-propylurea?
The molecular weight of 1-[3,5-Bis(trifluoromethyl)phenyl]-3-propylurea is 314.09 g/mol.
Where can I buy 1-[3,5-Bis(trifluoromethyl)phenyl]-3-propylurea?
You can request a quote for 1-[3,5-Bis(trifluoromethyl)phenyl]-3-propylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3,5-Bis(trifluoromethyl)phenyl]-3-propylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-[3,5-Bis(trifluoromethyl)phenyl]-3-propylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.