8-(3-chlorobenzene-1-sulfonyl)-3-(2-methylpropyl)-1-{[3-(trifluoromethyl)phenyl]methyl}-1,4,8-triazaspiro[4.5]decan-2-one
Chemical Structure Depiction of
8-(3-chlorobenzene-1-sulfonyl)-3-(2-methylpropyl)-1-{[3-(trifluoromethyl)phenyl]methyl}-1,4,8-triazaspiro[4.5]decan-2-one
8-(3-chlorobenzene-1-sulfonyl)-3-(2-methylpropyl)-1-{[3-(trifluoromethyl)phenyl]methyl}-1,4,8-triazaspiro[4.5]decan-2-one
Compound characteristics
| Compound ID: | V027-5234 |
| Compound Name: | 8-(3-chlorobenzene-1-sulfonyl)-3-(2-methylpropyl)-1-{[3-(trifluoromethyl)phenyl]methyl}-1,4,8-triazaspiro[4.5]decan-2-one |
| Molecular Weight: | 544.04 |
| Molecular Formula: | C25 H29 Cl F3 N3 O3 S |
| Salt: | not_available |
| Smiles: | CC(C)CC1C(N(Cc2cccc(c2)C(F)(F)F)C2(CCN(CC2)S(c2cccc(c2)[Cl])(=O)=O)N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.547 |
| logD: | 5.5233 |
| logSw: | -5.9315 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.382 |
| InChI Key: | VSSHGYJZNAOPEL-JOCHJYFZSA-N |