3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[(pyridin-2-yl)methyl]propanamide
Chemical Structure Depiction of
3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[(pyridin-2-yl)methyl]propanamide
3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[(pyridin-2-yl)methyl]propanamide
Compound characteristics
| Compound ID: | F797-0418 |
| Compound Name: | 3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[(pyridin-2-yl)methyl]propanamide |
| Molecular Weight: | 407.43 |
| Molecular Formula: | C21 H21 N5 O4 |
| Smiles: | COc1cc2c3c(C(N(CCC(NCc4ccccn4)=O)C=N3)=O)[nH]c2cc1OC |
| Stereo: | ACHIRAL |
| logP: | 0.566 |
| logD: | 0.5659 |
| logSw: | -1.927 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.551 |
| InChI Key: | JIMUBONWBUZPGU-UHFFFAOYSA-N |