4-(1-methyl-1H-imidazole-4-sulfonyl)-7-[(morpholin-4-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine
Chemical Structure Depiction of
4-(1-methyl-1H-imidazole-4-sulfonyl)-7-[(morpholin-4-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine
4-(1-methyl-1H-imidazole-4-sulfonyl)-7-[(morpholin-4-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine
Compound characteristics
| Compound ID: | T634-0032 |
| Compound Name: | 4-(1-methyl-1H-imidazole-4-sulfonyl)-7-[(morpholin-4-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine |
| Molecular Weight: | 392.48 |
| Molecular Formula: | C18 H24 N4 O4 S |
| Smiles: | Cn1cc(nc1)S(N1CCOc2ccc(CN3CCOCC3)cc2C1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.603 |
| logD: | 0.5262 |
| logSw: | -2.1314 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.946 |
| InChI Key: | SHZRLBSQBKIFKH-UHFFFAOYSA-N |