3-(4-methoxyphenyl)-8-[3-(trifluoromethyl)benzene-1-sulfonyl]-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Chemical Structure Depiction of
3-(4-methoxyphenyl)-8-[3-(trifluoromethyl)benzene-1-sulfonyl]-1,4,8-triazaspiro[4.5]dec-3-en-2-one
3-(4-methoxyphenyl)-8-[3-(trifluoromethyl)benzene-1-sulfonyl]-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Compound characteristics
| Compound ID: | G651-0733 |
| Compound Name: | 3-(4-methoxyphenyl)-8-[3-(trifluoromethyl)benzene-1-sulfonyl]-1,4,8-triazaspiro[4.5]dec-3-en-2-one |
| Molecular Weight: | 467.47 |
| Molecular Formula: | C21 H20 F3 N3 O4 S |
| Smiles: | COc1ccc(cc1)C1C(NC2(CCN(CC2)S(c2cccc(c2)C(F)(F)F)(=O)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2516 |
| logD: | 3.2468 |
| logSw: | -3.8069 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.844 |
| InChI Key: | ZVQPDRRWHOMBRE-UHFFFAOYSA-N |