2-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3-phenyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
2-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3-phenyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
2-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3-phenyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | G856-0816 |
| Compound Name: | 2-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3-phenyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 446.57 |
| Molecular Formula: | C25 H26 N4 O2 S |
| Smiles: | CCC1CCCCN1C(CSC1=Nc2c3ccccc3[nH]c2C(N1c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9205 |
| logD: | 3.9205 |
| logSw: | -3.9128 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.157 |
| InChI Key: | AQUBGYLTNRLHPB-KRWDZBQOSA-N |