3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-(4-fluorophenyl)propanamide
Chemical Structure Depiction of
3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-(4-fluorophenyl)propanamide
3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-(4-fluorophenyl)propanamide
Compound characteristics
| Compound ID: | F797-0417 |
| Compound Name: | 3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-(4-fluorophenyl)propanamide |
| Molecular Weight: | 410.4 |
| Molecular Formula: | C21 H19 F N4 O4 |
| Smiles: | COc1cc2c3c(C(N(CCC(Nc4ccc(cc4)F)=O)C=N3)=O)[nH]c2cc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.8047 |
| logD: | 1.8042 |
| logSw: | -2.385 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.686 |
| InChI Key: | FPBBJTOTXYTMGS-UHFFFAOYSA-N |