2-(3-methylphenyl)-5,7-di(propan-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Chemical Structure Depiction of
2-(3-methylphenyl)-5,7-di(propan-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
2-(3-methylphenyl)-5,7-di(propan-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Compound characteristics
Compound ID: | 4333-0833 |
Compound Name: | 2-(3-methylphenyl)-5,7-di(propan-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one |
Molecular Weight: | 326.48 |
Molecular Formula: | C21 H30 N2 O |
Smiles: | CC(C)C12CN3CC(CN(C1)C3c1cccc(C)c1)(C(C)C)C2=O |
Stereo: | ACHIRAL |
logP: | 4.2027 |
logD: | 4.2022 |
logSw: | -4.2619 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 19.9181 |
InChI Key: | XRJUSORHWNSNBQ-UHFFFAOYSA-N |