BIM-0002391.P001
TL;DR: BIM-0002391.P001 (CAS 374083-70-2) is a chemical compound with molecular formula C27H26F3N2O5P and molecular weight 546.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(Z)-1-diethoxyphosphoryl-3-oxo-1-phenyl-3-[2-(trifluoromethyl)anilino]prop-1-en-2-yl]benzamide
Also Known As: BIM-0002391.P001, N-[(Z)-1-diethoxyphosphoryl-3-oxo-1-phenyl-3-[2-(trifluoromethyl)anilino]prop-1-en-2-yl]benzamide, (2Z)-3-(diethoxycarbonyl)-3-phenyl-2-(phenylcarbonylamino)-N-[2-(trifluorometh yl)phenyl]prop-2-enamide, (Z)-diethyl (2-benzamido-3-oxo-1-phenyl-3-((2-(trifluoromethyl)phenyl)amino)prop-1-en-1-yl)phosphonate, diethyl [(1Z)-3-oxo-1-phenyl-2-[(phenylcarbonyl)amino]-3-{[2-(trifluoromethyl)phenyl]amino}prop-1-en-1-yl]phosphonate
| Molecular Formula | C27H26F3N2O5P |
|---|---|
| Molecular Weight | 546.15 g/mol |
| LogP | 6.7088 |
| Topological Polar Surface Area | 93.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 546.15314 |
| Heavy Atoms | 38 |
| Complexity | 1335.5789 |
Chemical Identifiers
| CAS Number | 374083-70-2 |
|---|---|
| SMILES | CCOP(=O)(/C(=C(/C(=O)NC1=CC=CC=C1C(F)(F)F)\NC(=O)C2=CC=CC=C2)/C3=CC=CC=C3)OCC |
Product Overview
BIM-0002391.P001 (CAS 374083-70-2), with molecular formula C27H26F3N2O5P and molecular weight 546.15 g/mol. IUPAC: N-[(Z)-1-diethoxyphosphoryl-3-oxo-1-phenyl-3-[2-(trifluoromethyl)anilino]prop-1-en-2-yl]benzamide.
Chemical Property Profile of BIM-0002391.P001
Property Insights of BIM-0002391.P001
The XLogP value of 6.7088 indicates that BIM-0002391.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.73 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0002391.P001. Following Lipinski's Rule of Five, BIM-0002391.P001 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BIM-0002391.P001?
The CAS number of BIM-0002391.P001 is 374083-70-2.
What is the molecular formula of BIM-0002391.P001?
The molecular formula of BIM-0002391.P001 is C27H26F3N2O5P.
What is the molecular weight of BIM-0002391.P001?
The molecular weight of BIM-0002391.P001 is 546.15 g/mol.
Where can I buy BIM-0002391.P001?
You can request a quote for BIM-0002391.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0002391.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0002391.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.