4-[(4-methylphenyl)methyl]-9-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)-1-oxa-9-azaspiro[5.5]undecane
Chemical Structure Depiction of
4-[(4-methylphenyl)methyl]-9-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)-1-oxa-9-azaspiro[5.5]undecane
4-[(4-methylphenyl)methyl]-9-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)-1-oxa-9-azaspiro[5.5]undecane
Compound characteristics
| Compound ID: | T500-1132 |
| Compound Name: | 4-[(4-methylphenyl)methyl]-9-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)-1-oxa-9-azaspiro[5.5]undecane |
| Molecular Weight: | 431.6 |
| Molecular Formula: | C23 H33 N3 O3 S |
| Smiles: | Cc1ccc(CC2CCOC3(CCN(CC3)S(c3c(C)nn(C)c3C)(=O)=O)C2)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2988 |
| logD: | 3.2988 |
| logSw: | -3.5038 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.119 |
| InChI Key: | FKBDTPYEVPAWMH-NRFANRHFSA-N |