7-(isoquinoline-1-carbonyl)-2-(4-methoxyphenyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
7-(isoquinoline-1-carbonyl)-2-(4-methoxyphenyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(1H)-one
7-(isoquinoline-1-carbonyl)-2-(4-methoxyphenyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(1H)-one
Compound characteristics
Compound ID: | S020-2631 |
Compound Name: | 7-(isoquinoline-1-carbonyl)-2-(4-methoxyphenyl)-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(1H)-one |
Molecular Weight: | 412.45 |
Molecular Formula: | C24 H20 N4 O3 |
Smiles: | COc1ccc(cc1)C1NC2CN(CCC=2C(N=1)=O)C(c1c2ccccc2ccn1)=O |
Stereo: | ACHIRAL |
logP: | 2.5028 |
logD: | 0.8527 |
logSw: | -2.9316 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 68.342 |
InChI Key: | YGQWZTOSIGDYRS-UHFFFAOYSA-N |