N-[2-(4-chlorophenyl)ethyl]-4-[(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-4-[(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzamide
N-[2-(4-chlorophenyl)ethyl]-4-[(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzamide
Compound characteristics
| Compound ID: | C307-0722 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-4-[(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzamide |
| Molecular Weight: | 432.91 |
| Molecular Formula: | C25 H21 Cl N2 O3 |
| Smiles: | CN1C(/C(=C/c2ccc(cc2)C(NCCc2ccc(cc2)[Cl])=O)Oc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1522 |
| logD: | 4.1522 |
| logSw: | -4.9029 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.325 |
| InChI Key: | PAVYGUZNWBQLGT-UHFFFAOYSA-N |