methyl (7,8-dimethyl-4-oxo-5-{2-oxo-2-[(3-phenylpropyl)amino]ethyl}-4,5-dihydro-1H-1,5-benzodiazepin-2-yl)acetate
Chemical Structure Depiction of
methyl (7,8-dimethyl-4-oxo-5-{2-oxo-2-[(3-phenylpropyl)amino]ethyl}-4,5-dihydro-1H-1,5-benzodiazepin-2-yl)acetate
methyl (7,8-dimethyl-4-oxo-5-{2-oxo-2-[(3-phenylpropyl)amino]ethyl}-4,5-dihydro-1H-1,5-benzodiazepin-2-yl)acetate
Compound characteristics
| Compound ID: | F404-0537 |
| Compound Name: | methyl (7,8-dimethyl-4-oxo-5-{2-oxo-2-[(3-phenylpropyl)amino]ethyl}-4,5-dihydro-1H-1,5-benzodiazepin-2-yl)acetate |
| Molecular Weight: | 435.52 |
| Molecular Formula: | C25 H29 N3 O4 |
| Smiles: | Cc1cc2c(cc1C)N(CC(NCCCc1ccccc1)=O)C(C=C(CC(=O)OC)N2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7031 |
| logD: | 3.3745 |
| logSw: | -4.0397 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.468 |
| InChI Key: | CRGPRYZNRVOVBU-UHFFFAOYSA-N |