methyl N-[2-(4-fluorophenyl)-4-oxo-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidine-7(1H)-carbonyl]valinate
Chemical Structure Depiction of
methyl N-[2-(4-fluorophenyl)-4-oxo-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidine-7(1H)-carbonyl]valinate
methyl N-[2-(4-fluorophenyl)-4-oxo-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidine-7(1H)-carbonyl]valinate
Compound characteristics
| Compound ID: | S020-2435 |
| Compound Name: | methyl N-[2-(4-fluorophenyl)-4-oxo-4,5,6,8-tetrahydropyrido[3,4-d]pyrimidine-7(1H)-carbonyl]valinate |
| Molecular Weight: | 402.42 |
| Molecular Formula: | C20 H23 F N4 O4 |
| Smiles: | CC(C)C(C(=O)OC)NC(N1CCC2=C(C1)NC(c1ccc(cc1)F)=NC2=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2158 |
| logD: | -0.6294 |
| logSw: | -2.8128 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.192 |
| InChI Key: | LQXCVWWMPQOOGP-INIZCTEOSA-N |