2-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3-methyl-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-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
2-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
Compound ID: | G856-0733 |
Compound Name: | 2-{[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
Molecular Weight: | 384.5 |
Molecular Formula: | C20 H24 N4 O2 S |
Smiles: | CCC1CCCCN1C(CSC1=Nc2c3ccccc3[nH]c2C(N1C)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.7308 |
logD: | 2.7308 |
logSw: | -3.0595 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.805 |
InChI Key: | OYRRJMUFLQVYOB-ZDUSSCGKSA-N |