1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-methylpropyl)-8-[3-(trifluoromethyl)benzene-1-sulfonyl]-1,4,8-triazaspiro[4.5]decan-2-one
Chemical Structure Depiction of
1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-methylpropyl)-8-[3-(trifluoromethyl)benzene-1-sulfonyl]-1,4,8-triazaspiro[4.5]decan-2-one
1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-methylpropyl)-8-[3-(trifluoromethyl)benzene-1-sulfonyl]-1,4,8-triazaspiro[4.5]decan-2-one
Compound characteristics
| Compound ID: | V002-4078 |
| Compound Name: | 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-(2-methylpropyl)-8-[3-(trifluoromethyl)benzene-1-sulfonyl]-1,4,8-triazaspiro[4.5]decan-2-one |
| Molecular Weight: | 583.67 |
| Molecular Formula: | C28 H36 F3 N3 O5 S |
| Salt: | not_available |
| Smiles: | CC(C)CC1C(N(CCc2ccc(c(c2)OC)OC)C2(CCN(CC2)S(c2cccc(c2)C(F)(F)F)(=O)=O)N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6351 |
| logD: | 4.35 |
| logSw: | -4.434 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.622 |
| InChI Key: | FKXXWHDWVRYOQT-HSZRJFAPSA-N |