2-[(3S)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-{1-[(4-fluorophenyl)methyl]piperidin-4-yl}acetamide
Chemical Structure Depiction of
2-[(3S)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-{1-[(4-fluorophenyl)methyl]piperidin-4-yl}acetamide
2-[(3S)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-{1-[(4-fluorophenyl)methyl]piperidin-4-yl}acetamide
Compound characteristics
| Compound ID: | J100-0255 |
| Compound Name: | 2-[(3S)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]-N-{1-[(4-fluorophenyl)methyl]piperidin-4-yl}acetamide |
| Molecular Weight: | 424.47 |
| Molecular Formula: | C23 H25 F N4 O3 |
| Smiles: | C1CN(CCC1NC(C[C@H]1C(Nc2ccccc2C(N1)=O)=O)=O)Cc1ccc(cc1)F |
| Stereo: | ABSOLUTE |
| logP: | 1.8988 |
| logD: | 0.7207 |
| logSw: | -2.8303 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 78.688 |
| InChI Key: | LKTOUCSHLGIWDX-FQEVSTJZSA-N |