5-butyl-7-methyl-2-(4-methylphenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Chemical Structure Depiction of
5-butyl-7-methyl-2-(4-methylphenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
5-butyl-7-methyl-2-(4-methylphenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Compound characteristics
| Compound ID: | D171-0138 |
| Compound Name: | 5-butyl-7-methyl-2-(4-methylphenyl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one |
| Molecular Weight: | 312.45 |
| Molecular Formula: | C20 H28 N2 O |
| Smiles: | CCCCC12CN3CC(C)(CN(C1)C3c1ccc(C)cc1)C2=O |
| Stereo: | ACHIRAL |
| logP: | 4.0834 |
| logD: | 4.0831 |
| logSw: | -3.9533 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 19.9181 |
| InChI Key: | YGXRWPHRQYFBTN-UHFFFAOYSA-N |