{9-hydroxy-9-[(4-methylpiperazin-1-yl)methyl]-3-azaspiro[5.5]undecan-3-yl}(2,4,6-trimethylphenyl)methanone
Chemical Structure Depiction of
{9-hydroxy-9-[(4-methylpiperazin-1-yl)methyl]-3-azaspiro[5.5]undecan-3-yl}(2,4,6-trimethylphenyl)methanone
{9-hydroxy-9-[(4-methylpiperazin-1-yl)methyl]-3-azaspiro[5.5]undecan-3-yl}(2,4,6-trimethylphenyl)methanone
Compound characteristics
| Compound ID: | CM3891-3654 |
| Compound Name: | {9-hydroxy-9-[(4-methylpiperazin-1-yl)methyl]-3-azaspiro[5.5]undecan-3-yl}(2,4,6-trimethylphenyl)methanone |
| Molecular Weight: | 427.63 |
| Molecular Formula: | C26 H41 N3 O2 |
| Smiles: | Cc1cc(C)c(C(N2CCC3(CCC(CC3)(CN3CCN(C)CC3)O)CC2)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.8658 |
| logD: | 1.7981 |
| logSw: | -2.6847 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.59 |
| InChI Key: | PQKFJOGDGRUVEO-UHFFFAOYSA-N |