1-[5-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl]-2-(3,4-dimethoxyphenyl)ethan-1-one
Chemical Structure Depiction of
1-[5-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl]-2-(3,4-dimethoxyphenyl)ethan-1-one
1-[5-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl]-2-(3,4-dimethoxyphenyl)ethan-1-one
Compound characteristics
| Compound ID: | T599-3750 |
| Compound Name: | 1-[5-(cyclopropanecarbonyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepin-1-yl]-2-(3,4-dimethoxyphenyl)ethan-1-one |
| Molecular Weight: | 394.47 |
| Molecular Formula: | C23 H26 N2 O4 |
| Smiles: | COc1ccc(CC(N2CCCN(C(C3CC3)=O)c3ccccc23)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.1405 |
| logD: | 3.1405 |
| logSw: | -3.3511 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.531 |
| InChI Key: | CORUGMWLNDXDDK-UHFFFAOYSA-N |