(3S)-7-(3-fluorophenyl)-3-methyl-4-[(4-methyl-1,3-thiazol-5-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine
Chemical Structure Depiction of
(3S)-7-(3-fluorophenyl)-3-methyl-4-[(4-methyl-1,3-thiazol-5-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine
(3S)-7-(3-fluorophenyl)-3-methyl-4-[(4-methyl-1,3-thiazol-5-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine
Compound characteristics
| Compound ID: | SC09-0142 |
| Compound Name: | (3S)-7-(3-fluorophenyl)-3-methyl-4-[(4-methyl-1,3-thiazol-5-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepine |
| Molecular Weight: | 368.47 |
| Molecular Formula: | C21 H21 F N2 O S |
| Smiles: | Cc1c(CN2Cc3cc(ccc3OC[C@@H]2C)c2cccc(c2)F)scn1 |
| Stereo: | ABSOLUTE |
| logP: | 5.0625 |
| logD: | 4.7743 |
| logSw: | -4.8307 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 21.7973 |
| InChI Key: | INPZICYOELMZDX-AWEZNQCLSA-N |