2-phenyl-7-(3-phenyl-1H-pyrazole-5-carbonyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
2-phenyl-7-(3-phenyl-1H-pyrazole-5-carbonyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(1H)-one
2-phenyl-7-(3-phenyl-1H-pyrazole-5-carbonyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(1H)-one
Compound characteristics
Compound ID: | S020-1036 |
Compound Name: | 2-phenyl-7-(3-phenyl-1H-pyrazole-5-carbonyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(1H)-one |
Molecular Weight: | 397.44 |
Molecular Formula: | C23 H19 N5 O2 |
Smiles: | C1CN(CC2=C1C(N=C(c1ccccc1)N2)=O)C(c1cc(c2ccccc2)n[nH]1)=O |
Stereo: | ACHIRAL |
logP: | 2.9821 |
logD: | 1.0329 |
logSw: | -3.3953 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 73.741 |
InChI Key: | FLEZGSVVYUCBJP-UHFFFAOYSA-N |