3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-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-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]propanamide
3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]propanamide
Compound characteristics
Compound ID: | F797-0484 |
Compound Name: | 3-(7,8-dimethoxy-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-3-yl)-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]propanamide |
Molecular Weight: | 438.49 |
Molecular Formula: | C22 H26 N6 O4 |
Smiles: | Cc1c(CNC(CCN2C=Nc3c4cc(c(cc4[nH]c3C2=O)OC)OC)=O)c(C)n(C)n1 |
Stereo: | ACHIRAL |
logP: | 0.2225 |
logD: | 0.2224 |
logSw: | -1.5664 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 88.847 |
InChI Key: | SOBIYUBWLISDSW-UHFFFAOYSA-N |