2-(ethylsulfanyl)-3-(4-methoxyphenyl)-N-[2-(trifluoromethyl)phenyl]-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide
Chemical Structure Depiction of
2-(ethylsulfanyl)-3-(4-methoxyphenyl)-N-[2-(trifluoromethyl)phenyl]-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide
2-(ethylsulfanyl)-3-(4-methoxyphenyl)-N-[2-(trifluoromethyl)phenyl]-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide
Compound characteristics
| Compound ID: | E972-0227 |
| Compound Name: | 2-(ethylsulfanyl)-3-(4-methoxyphenyl)-N-[2-(trifluoromethyl)phenyl]-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide |
| Molecular Weight: | 490.55 |
| Molecular Formula: | C24 H25 F3 N4 O2 S |
| Smiles: | CCSC1C(c2ccc(cc2)OC)=NC2(CCN(CC2)C(Nc2ccccc2C(F)(F)F)=O)N=1 |
| Stereo: | ACHIRAL |
| logP: | 4.6517 |
| logD: | 4.6517 |
| logSw: | -4.2985 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.475 |
| InChI Key: | GNXKLNSPVOIFIW-UHFFFAOYSA-N |