8-(2,5-dimethoxybenzene-1-sulfonyl)-3-(4-fluorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Chemical Structure Depiction of
8-(2,5-dimethoxybenzene-1-sulfonyl)-3-(4-fluorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
8-(2,5-dimethoxybenzene-1-sulfonyl)-3-(4-fluorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Compound characteristics
| Compound ID: | G651-0541 |
| Compound Name: | 8-(2,5-dimethoxybenzene-1-sulfonyl)-3-(4-fluorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one |
| Molecular Weight: | 447.48 |
| Molecular Formula: | C21 H22 F N3 O5 S |
| Smiles: | COc1ccc(c(c1)S(N1CCC2(CC1)NC(C(c1ccc(cc1)F)=N2)=O)(=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.2959 |
| logD: | 2.2911 |
| logSw: | -3.114 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.475 |
| InChI Key: | GZCOQGMROHDODA-UHFFFAOYSA-N |