8-chloro-2-{[4-(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)piperazin-1-yl]methyl}quinolin-4(1H)-one
Chemical Structure Depiction of
8-chloro-2-{[4-(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)piperazin-1-yl]methyl}quinolin-4(1H)-one
8-chloro-2-{[4-(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)piperazin-1-yl]methyl}quinolin-4(1H)-one
Compound characteristics
| Compound ID: | G753-0633 |
| Compound Name: | 8-chloro-2-{[4-(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)piperazin-1-yl]methyl}quinolin-4(1H)-one |
| Molecular Weight: | 439.98 |
| Molecular Formula: | C25 H30 Cl N3 O2 |
| Smiles: | [H][C@@]12CC3(C[C@@]([H])(C1)C[C@]([H])(C3)C2)C(N1CCN(CC1)CC1=CC(c2cccc(c2N1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5395 |
| logD: | 4.167 |
| logSw: | -4.657 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.003 |
| InChI Key: | GOZMELSXYWEIBN-UHFFFAOYSA-N |