(3S)-4-cyclohexyl-3-methyl-7-(pyridin-4-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine
Chemical Structure Depiction of
(3S)-4-cyclohexyl-3-methyl-7-(pyridin-4-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine
(3S)-4-cyclohexyl-3-methyl-7-(pyridin-4-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine
Compound characteristics
| Compound ID: | SC09-0443 |
| Compound Name: | (3S)-4-cyclohexyl-3-methyl-7-(pyridin-4-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine |
| Molecular Weight: | 322.45 |
| Molecular Formula: | C21 H26 N2 O |
| Smiles: | C[C@H]1COc2ccc(cc2CN1C1CCCCC1)c1ccncc1 |
| Stereo: | ABSOLUTE |
| logP: | 4.9672 |
| logD: | 3.8556 |
| logSw: | -4.6769 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.4078 |
| InChI Key: | XQWXAYGXOQCABJ-INIZCTEOSA-N |