methyl 2-[(2-phenyl-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 2-[(2-phenyl-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carbonyl)amino]benzoate
methyl 2-[(2-phenyl-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | M568-0309 |
| Compound Name: | methyl 2-[(2-phenyl-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-carbonyl)amino]benzoate |
| Molecular Weight: | 388.42 |
| Molecular Formula: | C22 H20 N4 O3 |
| Smiles: | COC(c1ccccc1NC(N1CCc2c(C1)cnc(c1ccccc1)n2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6397 |
| logD: | 3.6392 |
| logSw: | -3.7253 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.168 |
| InChI Key: | SEDDDLCZASPGMN-UHFFFAOYSA-N |