N-[(3,4-dimethoxyphenyl)methyl]-3-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]propanamide
Chemical Structure Depiction of
N-[(3,4-dimethoxyphenyl)methyl]-3-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]propanamide
N-[(3,4-dimethoxyphenyl)methyl]-3-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]propanamide
Compound characteristics
| Compound ID: | Y040-5738 |
| Compound Name: | N-[(3,4-dimethoxyphenyl)methyl]-3-[(3R)-2,5-dioxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-3-yl]propanamide |
| Molecular Weight: | 397.43 |
| Molecular Formula: | C21 H23 N3 O5 |
| Smiles: | COc1ccc(CNC(CC[C@@H]2C(Nc3ccccc3C(N2)=O)=O)=O)cc1OC |
| Stereo: | ABSOLUTE |
| logP: | 1.6923 |
| logD: | 1.6818 |
| logSw: | -2.5618 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.683 |
| InChI Key: | QEMPLWYAYTXXKF-INIZCTEOSA-N |