1-(1,1,1,3,3,3-Hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)urea
TL;DR: 1-(1,1,1,3,3,3-Hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)urea (CAS 355829-39-9) is a chemical compound with molecular formula C10H12F6N4O and molecular weight 318.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1,1,1,3,3,3-hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)urea
Also Known As: CBKinase1_010690, CBKinase1_023090, BRD-K92211742-001-01-8, 1-(1,1,1,3,3,3-hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)urea, 1-(1,1,1,3,3,3-hexafluoropropan-2-yl)-3-[3-(1H-imidazol-1-yl)propyl]urea
| Molecular Formula | C10H12F6N4O |
|---|---|
| Molecular Weight | 318.09 g/mol |
| LogP | 2.0656 |
| Topological Polar Surface Area | 58.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.09152 |
| Heavy Atoms | 21 |
| Complexity | 427.39066 |
Chemical Identifiers
| CAS Number | 355829-39-9 |
|---|---|
| SMILES | C1=CN(C=N1)CCCNC(=O)NC(C(F)(F)F)C(F)(F)F |
Product Overview
1-(1,1,1,3,3,3-Hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)urea (CAS 355829-39-9), with molecular formula C10H12F6N4O and molecular weight 318.09 g/mol. IUPAC: 1-(1,1,1,3,3,3-hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)urea.
Chemical Property Profile of 1-(1,1,1,3,3,3-Hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)urea
Property Insights of 1-(1,1,1,3,3,3-Hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)urea
The XLogP value of 2.0656 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1,1,1,3,3,3-Hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)urea. With a topological polar surface area (TPSA) of 58.95 Ų, 1-(1,1,1,3,3,3-Hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1,1,1,3,3,3-Hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)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-(1,1,1,3,3,3-Hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)urea?
The CAS number of 1-(1,1,1,3,3,3-Hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)urea is 355829-39-9.
What is the molecular formula of 1-(1,1,1,3,3,3-Hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)urea?
The molecular formula of 1-(1,1,1,3,3,3-Hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)urea is C10H12F6N4O.
What is the molecular weight of 1-(1,1,1,3,3,3-Hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)urea?
The molecular weight of 1-(1,1,1,3,3,3-Hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)urea is 318.09 g/mol.
Where can I buy 1-(1,1,1,3,3,3-Hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)urea?
You can request a quote for 1-(1,1,1,3,3,3-Hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,1,1,3,3,3-Hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,1,1,3,3,3-Hexafluoropropan-2-yl)-3-(3-imidazol-1-ylpropyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.