8-(3,4-dichlorobenzene-1-sulfonyl)-3-methyl-1-{[3-(trifluoromethyl)phenyl]methyl}-1,4,8-triazaspiro[4.5]decan-2-one
Chemical Structure Depiction of
8-(3,4-dichlorobenzene-1-sulfonyl)-3-methyl-1-{[3-(trifluoromethyl)phenyl]methyl}-1,4,8-triazaspiro[4.5]decan-2-one
8-(3,4-dichlorobenzene-1-sulfonyl)-3-methyl-1-{[3-(trifluoromethyl)phenyl]methyl}-1,4,8-triazaspiro[4.5]decan-2-one
Compound characteristics
| Compound ID: | V026-2300 |
| Compound Name: | 8-(3,4-dichlorobenzene-1-sulfonyl)-3-methyl-1-{[3-(trifluoromethyl)phenyl]methyl}-1,4,8-triazaspiro[4.5]decan-2-one |
| Molecular Weight: | 536.4 |
| Molecular Formula: | C22 H22 Cl2 F3 N3 O3 S |
| Salt: | not_available |
| Smiles: | CC1C(N(Cc2cccc(c2)C(F)(F)F)C2(CCN(CC2)S(c2ccc(c(c2)[Cl])[Cl])(=O)=O)N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.948 |
| logD: | 4.9271 |
| logSw: | -5.1036 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.776 |
| InChI Key: | ZBPSJHABBSZEGP-CQSZACIVSA-N |