8-chloro-3-[(2-ethylpyrrolidin-1-yl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
8-chloro-3-[(2-ethylpyrrolidin-1-yl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
8-chloro-3-[(2-ethylpyrrolidin-1-yl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | D007-0389 |
| Compound Name: | 8-chloro-3-[(2-ethylpyrrolidin-1-yl)methyl]-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 330.82 |
| Molecular Formula: | C17 H19 Cl N4 O |
| Smiles: | CCC1CCCN1CN1C=Nc2c3cc(ccc3[nH]c2C1=O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9856 |
| logD: | 1.8503 |
| logSw: | -3.5515 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.901 |
| InChI Key: | LECVQLMDTQXBAE-LBPRGKRZSA-N |