3-(7,8-dimethoxy-2-oxo-1,2-dihydro-3H-3-benzazepin-3-yl)-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}propanamide
Chemical Structure Depiction of
3-(7,8-dimethoxy-2-oxo-1,2-dihydro-3H-3-benzazepin-3-yl)-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}propanamide
3-(7,8-dimethoxy-2-oxo-1,2-dihydro-3H-3-benzazepin-3-yl)-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}propanamide
Compound characteristics
| Compound ID: | Y043-5698 |
| Compound Name: | 3-(7,8-dimethoxy-2-oxo-1,2-dihydro-3H-3-benzazepin-3-yl)-N-{5-[(4-methoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl}propanamide |
| Molecular Weight: | 494.57 |
| Molecular Formula: | C25 H26 N4 O5 S |
| Smiles: | COc1ccc(Cc2nnc(NC(CCN3C=Cc4cc(c(cc4CC3=O)OC)OC)=O)s2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.6477 |
| logD: | 2.6029 |
| logSw: | -3.2597 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.991 |
| InChI Key: | SUADLQSDHBGTSN-UHFFFAOYSA-N |