3-ethyl-2-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-8-methoxy-5-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-ethyl-2-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-8-methoxy-5-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-ethyl-2-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-8-methoxy-5-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | L880-0071 |
| Compound Name: | 3-ethyl-2-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-8-methoxy-5-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 442.58 |
| Molecular Formula: | C23 H30 N4 O3 S |
| Smiles: | CCC1CCCCN1C(CSC1=Nc2c3cc(ccc3n(C)c2C(N1CC)=O)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5153 |
| logD: | 3.5153 |
| logSw: | -3.8232 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.021 |
| InChI Key: | DKNJDYQAQVGOAU-HNNXBMFYSA-N |