N-cyclopropyl-3-[4-(2,4-dimethyl-1,3-thiazole-5-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
Chemical Structure Depiction of
N-cyclopropyl-3-[4-(2,4-dimethyl-1,3-thiazole-5-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
N-cyclopropyl-3-[4-(2,4-dimethyl-1,3-thiazole-5-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide
Compound characteristics
| Compound ID: | S629-1692 |
| Compound Name: | N-cyclopropyl-3-[4-(2,4-dimethyl-1,3-thiazole-5-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]propanamide |
| Molecular Weight: | 399.51 |
| Molecular Formula: | C21 H25 N3 O3 S |
| Smiles: | Cc1c(C(N2CCOc3ccc(CCC(NC4CC4)=O)cc3C2)=O)sc(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.7733 |
| logD: | 2.7732 |
| logSw: | -3.2621 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.476 |
| InChI Key: | RCYDPHMWLBHFLZ-UHFFFAOYSA-N |