2-[(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)methyl]-N-[(2-methylphenyl)methyl]benzamide
Chemical Structure Depiction of
2-[(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)methyl]-N-[(2-methylphenyl)methyl]benzamide
2-[(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)methyl]-N-[(2-methylphenyl)methyl]benzamide
Compound characteristics
| Compound ID: | L610-0389 |
| Compound Name: | 2-[(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)methyl]-N-[(2-methylphenyl)methyl]benzamide |
| Molecular Weight: | 453.54 |
| Molecular Formula: | C28 H27 N3 O3 |
| Smiles: | Cc1ccccc1CNC(c1ccccc1CN1C(C2CCCN2C(c2ccccc12)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9175 |
| logD: | 3.9162 |
| logSw: | -3.9351 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.686 |
| InChI Key: | PPLODXCLERCREQ-VWLOTQADSA-N |