1-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-8-methoxy-5-methyl-3-(3-methylphenyl)-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Chemical Structure Depiction of
1-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-8-methoxy-5-methyl-3-(3-methylphenyl)-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
1-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-8-methoxy-5-methyl-3-(3-methylphenyl)-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione
Compound characteristics
| Compound ID: | E737-0855 |
| Compound Name: | 1-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-8-methoxy-5-methyl-3-(3-methylphenyl)-1H-pyrimido[5,4-b]indole-2,4(3H,5H)-dione |
| Molecular Weight: | 488.59 |
| Molecular Formula: | C28 H32 N4 O4 |
| Smiles: | CCC1CCCCN1C(CN1C(N(C(c2c1c1cc(ccc1n2C)OC)=O)c1cccc(C)c1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9435 |
| logD: | 3.9435 |
| logSw: | -3.9503 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.318 |
| InChI Key: | RWPHMZMVPCBUGO-IBGZPJMESA-N |