1-[2-(3,4-dimethoxyphenyl)ethyl]-8-(3-fluorobenzoyl)-3-(2-methylpropyl)-1,4,8-triazaspiro[4.5]decan-2-one
Chemical Structure Depiction of
1-[2-(3,4-dimethoxyphenyl)ethyl]-8-(3-fluorobenzoyl)-3-(2-methylpropyl)-1,4,8-triazaspiro[4.5]decan-2-one
1-[2-(3,4-dimethoxyphenyl)ethyl]-8-(3-fluorobenzoyl)-3-(2-methylpropyl)-1,4,8-triazaspiro[4.5]decan-2-one
Compound characteristics
| Compound ID: | V026-7777 |
| Compound Name: | 1-[2-(3,4-dimethoxyphenyl)ethyl]-8-(3-fluorobenzoyl)-3-(2-methylpropyl)-1,4,8-triazaspiro[4.5]decan-2-one |
| Molecular Weight: | 497.61 |
| Molecular Formula: | C28 H36 F N3 O4 |
| Salt: | not_available |
| Smiles: | CC(C)CC1C(N(CCc2ccc(c(c2)OC)OC)C2(CCN(CC2)C(c2cccc(c2)F)=O)N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3135 |
| logD: | 2.1336 |
| logSw: | -3.7136 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.559 |
| InChI Key: | APWGWAGTQONZDX-HSZRJFAPSA-N |