5,7-di(propan-2-yl)-2-{4-[(prop-2-en-1-yl)oxy]phenyl}-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Chemical Structure Depiction of
5,7-di(propan-2-yl)-2-{4-[(prop-2-en-1-yl)oxy]phenyl}-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
5,7-di(propan-2-yl)-2-{4-[(prop-2-en-1-yl)oxy]phenyl}-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Compound characteristics
Compound ID: | 4036-0054 |
Compound Name: | 5,7-di(propan-2-yl)-2-{4-[(prop-2-en-1-yl)oxy]phenyl}-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one |
Molecular Weight: | 368.52 |
Molecular Formula: | C23 H32 N2 O2 |
Smiles: | CC(C)C12CN3CC(CN(C1)C3c1ccc(cc1)OCC=C)(C(C)C)C2=O |
Stereo: | ACHIRAL |
logP: | 4.2282 |
logD: | 4.2281 |
logSw: | -4.1583 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 27.3358 |
InChI Key: | HTCSOHBABRIFJL-UHFFFAOYSA-N |