4-methyl-5-(3-phenylprop-2-enoyl)-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Chemical Structure Depiction of
4-methyl-5-(3-phenylprop-2-enoyl)-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
4-methyl-5-(3-phenylprop-2-enoyl)-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one
Compound characteristics
| Compound ID: | D428-0056 |
| Compound Name: | 4-methyl-5-(3-phenylprop-2-enoyl)-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one |
| Molecular Weight: | 306.36 |
| Molecular Formula: | C19 H18 N2 O2 |
| Smiles: | CC1CC(Nc2ccccc2N1C(/C=C/c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8229 |
| logD: | 2.7924 |
| logSw: | -3.3367 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.194 |
| InChI Key: | PMCZQOFYTOBCHT-AWEZNQCLSA-N |