(3S)-3-methyl-4-[(5-methylfuran-2-yl)methyl]-7-(pyridin-4-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine
Chemical Structure Depiction of
(3S)-3-methyl-4-[(5-methylfuran-2-yl)methyl]-7-(pyridin-4-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine
(3S)-3-methyl-4-[(5-methylfuran-2-yl)methyl]-7-(pyridin-4-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine
Compound characteristics
| Compound ID: | SC09-0370 |
| Compound Name: | (3S)-3-methyl-4-[(5-methylfuran-2-yl)methyl]-7-(pyridin-4-yl)-2,3,4,5-tetrahydro-1,4-benzoxazepine |
| Molecular Weight: | 334.42 |
| Molecular Formula: | C21 H22 N2 O2 |
| Smiles: | Cc1ccc(CN2Cc3cc(ccc3OC[C@@H]2C)c2ccncc2)o1 |
| Stereo: | ABSOLUTE |
| logP: | 4.199 |
| logD: | 3.5815 |
| logSw: | -4.3048 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 28.2834 |
| InChI Key: | YCMZTEQZMVCWSS-HNNXBMFYSA-N |