TimTec1_002072
TL;DR: TimTec1_002072 (CAS 1085449-55-3) is a chemical compound with molecular formula C17H14N2O and molecular weight 262.11063 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-benzyl-3-(4-cyanophenyl)prop-2-enamide
Also Known As: TimTec1_002072, N-benzyl-3-(4-cyanophenyl)prop-2-enamide, (E)-N-benzyl-3-(4-cyanophenyl)-2-propenamide
Technical Specifications
| Molecular Formula | C17H14N2O |
| Molecular Weight | 262.11063 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 262.11063 Da |
| Heavy Atoms | 20 |
| Complexity | 379.0 |
| SMILES | C1=CC=C(C=C1)CNC(=O)C=CC2=CC=C(C=C2)C#N |
| InChIKey | CZRJKPRIEGPAQT-UHFFFAOYSA-N |
Chemical Property Profile of TimTec1_002072
Property Insights of TimTec1_002072
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for TimTec1_002072. With a topological polar surface area (TPSA) of 52.9 Ų, TimTec1_002072 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, TimTec1_002072 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of TimTec1_002072?
The CAS number of TimTec1_002072 is 1085449-55-3.
What is the molecular formula of TimTec1_002072?
The molecular formula of TimTec1_002072 is C17H14N2O.
What is the molecular weight of TimTec1_002072?
The molecular weight of TimTec1_002072 is 262.11063 g/mol.
Where can I buy TimTec1_002072?
You can request a quote for TimTec1_002072 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for TimTec1_002072?
Yes, CoreyChem provides custom synthesis services for TimTec1_002072 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.