2-(4-methoxyphenyl)-7-[4-(trifluoromethoxy)benzoyl]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
2-(4-methoxyphenyl)-7-[4-(trifluoromethoxy)benzoyl]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(1H)-one
2-(4-methoxyphenyl)-7-[4-(trifluoromethoxy)benzoyl]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | S020-2592 |
| Compound Name: | 2-(4-methoxyphenyl)-7-[4-(trifluoromethoxy)benzoyl]-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 445.4 |
| Molecular Formula: | C22 H18 F3 N3 O4 |
| Smiles: | COc1ccc(cc1)C1NC2CN(CCC=2C(N=1)=O)C(c1ccc(cc1)OC(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3914 |
| logD: | 1.7675 |
| logSw: | -3.6409 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.732 |
| InChI Key: | BILRHILUNGOLKE-UHFFFAOYSA-N |