4-(4-chlorophenyl)-8-[4-(trifluoromethyl)benzoyl]-1-thia-4,8-diazaspiro[4.5]decan-3-one
Chemical Structure Depiction of
4-(4-chlorophenyl)-8-[4-(trifluoromethyl)benzoyl]-1-thia-4,8-diazaspiro[4.5]decan-3-one
4-(4-chlorophenyl)-8-[4-(trifluoromethyl)benzoyl]-1-thia-4,8-diazaspiro[4.5]decan-3-one
Compound characteristics
| Compound ID: | V009-0470 |
| Compound Name: | 4-(4-chlorophenyl)-8-[4-(trifluoromethyl)benzoyl]-1-thia-4,8-diazaspiro[4.5]decan-3-one |
| Molecular Weight: | 454.9 |
| Molecular Formula: | C21 H18 Cl F3 N2 O2 S |
| Smiles: | C1CN(CCC12N(C(CS2)=O)c1ccc(cc1)[Cl])C(c1ccc(cc1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0459 |
| logD: | 4.0459 |
| logSw: | -4.5469 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.568 |
| InChI Key: | BYEMMYHUSGJBLT-UHFFFAOYSA-N |