methyl 2-[2-(2-oxo-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)acetamido]benzoate
Chemical Structure Depiction of
methyl 2-[2-(2-oxo-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)acetamido]benzoate
methyl 2-[2-(2-oxo-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | K788-2274 |
| Compound Name: | methyl 2-[2-(2-oxo-5-phenyl-2,3-dihydro-1H-1,4-benzodiazepin-1-yl)acetamido]benzoate |
| Molecular Weight: | 427.46 |
| Molecular Formula: | C25 H21 N3 O4 |
| Smiles: | COC(c1ccccc1NC(CN1C(CN=C(c2ccccc2)c2ccccc12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9778 |
| logD: | 2.9563 |
| logSw: | -3.503 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.567 |
| InChI Key: | NBVJIABMYONGJM-UHFFFAOYSA-N |