8-(4-chloro-2-methylbenzene-1-sulfonyl)-2-[(4-methylpiperazin-1-yl)methyl]-1-oxa-8-azaspiro[4.5]decane
Chemical Structure Depiction of
8-(4-chloro-2-methylbenzene-1-sulfonyl)-2-[(4-methylpiperazin-1-yl)methyl]-1-oxa-8-azaspiro[4.5]decane
8-(4-chloro-2-methylbenzene-1-sulfonyl)-2-[(4-methylpiperazin-1-yl)methyl]-1-oxa-8-azaspiro[4.5]decane
Compound characteristics
| Compound ID: | CM3542-3164 |
| Compound Name: | 8-(4-chloro-2-methylbenzene-1-sulfonyl)-2-[(4-methylpiperazin-1-yl)methyl]-1-oxa-8-azaspiro[4.5]decane |
| Molecular Weight: | 442.02 |
| Molecular Formula: | C21 H32 Cl N3 O3 S |
| Smiles: | Cc1cc(ccc1S(N1CCC2(CCC(CN3CCN(C)CC3)O2)CC1)(=O)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0849 |
| logD: | 2.0597 |
| logSw: | -3.3589 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 45.485 |
| InChI Key: | IVOGLGJIEWLFPG-IBGZPJMESA-N |