5-(3-phenylprop-2-enoyl)-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Chemical Structure Depiction of
5-(3-phenylprop-2-enoyl)-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
5-(3-phenylprop-2-enoyl)-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Compound characteristics
| Compound ID: | D428-0012 |
| Compound Name: | 5-(3-phenylprop-2-enoyl)-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one |
| Molecular Weight: | 292.34 |
| Molecular Formula: | C18 H16 N2 O2 |
| Smiles: | C1CN(C(/C=C/c2ccccc2)=O)c2ccccc2NC1=O |
| Stereo: | ACHIRAL |
| logP: | 2.5608 |
| logD: | 2.5402 |
| logSw: | -2.9456 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.255 |
| InChI Key: | MTDSDASRMRLZEA-UHFFFAOYSA-N |