1-[2-(3,4-dimethoxyphenyl)ethyl]-8-(4-fluorobenzene-1-sulfonyl)-3-(propan-2-yl)-1,4,8-triazaspiro[4.5]decan-2-one
Chemical Structure Depiction of
1-[2-(3,4-dimethoxyphenyl)ethyl]-8-(4-fluorobenzene-1-sulfonyl)-3-(propan-2-yl)-1,4,8-triazaspiro[4.5]decan-2-one
1-[2-(3,4-dimethoxyphenyl)ethyl]-8-(4-fluorobenzene-1-sulfonyl)-3-(propan-2-yl)-1,4,8-triazaspiro[4.5]decan-2-one
Compound characteristics
| Compound ID: | V026-2658 |
| Compound Name: | 1-[2-(3,4-dimethoxyphenyl)ethyl]-8-(4-fluorobenzene-1-sulfonyl)-3-(propan-2-yl)-1,4,8-triazaspiro[4.5]decan-2-one |
| Molecular Weight: | 519.64 |
| Molecular Formula: | C26 H34 F N3 O5 S |
| Salt: | not_available |
| Smiles: | CC(C)C1C(N(CCc2ccc(c(c2)OC)OC)C2(CCN(CC2)S(c2ccc(cc2)F)(=O)=O)N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4017 |
| logD: | 2.9816 |
| logSw: | -3.8907 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.516 |
| InChI Key: | XVAMWVKOSBESAG-XMMPIXPASA-N |