2-(4-ethylphenyl)-5-methyl-7-propyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Chemical Structure Depiction of
2-(4-ethylphenyl)-5-methyl-7-propyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
2-(4-ethylphenyl)-5-methyl-7-propyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Compound characteristics
Compound ID: | D171-0106 |
Compound Name: | 2-(4-ethylphenyl)-5-methyl-7-propyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one |
Molecular Weight: | 312.45 |
Molecular Formula: | C20 H28 N2 O |
Smiles: | CCCC12CN3CC(C)(CN(C1)C3c1ccc(CC)cc1)C2=O |
Stereo: | ACHIRAL |
logP: | 4.1513 |
logD: | 4.151 |
logSw: | -3.9743 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 19.9181 |
InChI Key: | KZGQKKRRXJVJRC-UHFFFAOYSA-N |