3-[(2-ethylpyrrolidin-1-yl)methyl]-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
3-[(2-ethylpyrrolidin-1-yl)methyl]-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
3-[(2-ethylpyrrolidin-1-yl)methyl]-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | D007-0097 |
| Compound Name: | 3-[(2-ethylpyrrolidin-1-yl)methyl]-8-methyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 310.4 |
| Molecular Formula: | C18 H22 N4 O |
| Smiles: | CCC1CCCN1CN1C=Nc2c3cc(C)ccc3[nH]c2C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7633 |
| logD: | 1.628 |
| logSw: | -2.9275 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.901 |
| InChI Key: | BMDAFORRXMVQSB-ZDUSSCGKSA-N |