8-(4-chlorobutanoyl)-4-[3-(trifluoromethyl)phenyl]-1-thia-4,8-diazaspiro[4.5]decan-3-one
Chemical Structure Depiction of
8-(4-chlorobutanoyl)-4-[3-(trifluoromethyl)phenyl]-1-thia-4,8-diazaspiro[4.5]decan-3-one
8-(4-chlorobutanoyl)-4-[3-(trifluoromethyl)phenyl]-1-thia-4,8-diazaspiro[4.5]decan-3-one
Compound characteristics
| Compound ID: | V029-1068 |
| Compound Name: | 8-(4-chlorobutanoyl)-4-[3-(trifluoromethyl)phenyl]-1-thia-4,8-diazaspiro[4.5]decan-3-one |
| Molecular Weight: | 420.88 |
| Molecular Formula: | C18 H20 Cl F3 N2 O2 S |
| Smiles: | C(CC(N1CCC2(CC1)N(C(CS2)=O)c1cccc(c1)C(F)(F)F)=O)C[Cl] |
| Stereo: | ACHIRAL |
| logP: | 2.9306 |
| logD: | 2.9306 |
| logSw: | -3.2335 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.312 |
| InChI Key: | GTHSTBVNBGTMEI-UHFFFAOYSA-N |