3-ethyl-8-methoxy-5-methyl-2-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-ethyl-8-methoxy-5-methyl-2-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-ethyl-8-methoxy-5-methyl-2-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | L880-0070 |
| Compound Name: | 3-ethyl-8-methoxy-5-methyl-2-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 428.55 |
| Molecular Formula: | C22 H28 N4 O3 S |
| Smiles: | CCN1C(=Nc2c3cc(ccc3n(C)c2C1=O)OC)SCC(N1CCC(C)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1144 |
| logD: | 3.1144 |
| logSw: | -3.305 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 49.375 |
| InChI Key: | SXXAHHQZVMTUIJ-UHFFFAOYSA-N |