(3S)-N-ethyl-3-methyl-7-(pyridin-3-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Chemical Structure Depiction of
(3S)-N-ethyl-3-methyl-7-(pyridin-3-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
(3S)-N-ethyl-3-methyl-7-(pyridin-3-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Compound characteristics
| Compound ID: | SC09-0512 |
| Compound Name: | (3S)-N-ethyl-3-methyl-7-(pyridin-3-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide |
| Molecular Weight: | 311.38 |
| Molecular Formula: | C18 H21 N3 O2 |
| Smiles: | CCNC(N1Cc2cc(ccc2OC[C@@H]1C)c1cccnc1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.9308 |
| logD: | 2.9239 |
| logSw: | -3.1254 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.901 |
| InChI Key: | QLNWNYOPGQLFID-ZDUSSCGKSA-N |