N-{1-[(4-cyanophenyl)methyl]piperidin-4-yl}-2-(2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl)acetamide
Chemical Structure Depiction of
N-{1-[(4-cyanophenyl)methyl]piperidin-4-yl}-2-(2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl)acetamide
N-{1-[(4-cyanophenyl)methyl]piperidin-4-yl}-2-(2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl)acetamide
Compound characteristics
| Compound ID: | Y042-2638 |
| Compound Name: | N-{1-[(4-cyanophenyl)methyl]piperidin-4-yl}-2-(2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl)acetamide |
| Molecular Weight: | 431.49 |
| Molecular Formula: | C24 H25 N5 O3 |
| Smiles: | C1CN(CCC1NC(CC1C(Nc2ccccc2C(N1)=O)=O)=O)Cc1ccc(C#N)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5242 |
| logD: | 0.4383 |
| logSw: | -2.4756 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 95.744 |
| InChI Key: | YPKAQKFLJNBJHJ-NRFANRHFSA-N |