7-benzyl-1,3-dimethylpyrido[3,4-d]pyrimidine-2,4,5,6,8(1H,3H,7H)-pentone
Chemical Structure Depiction of
7-benzyl-1,3-dimethylpyrido[3,4-d]pyrimidine-2,4,5,6,8(1H,3H,7H)-pentone
7-benzyl-1,3-dimethylpyrido[3,4-d]pyrimidine-2,4,5,6,8(1H,3H,7H)-pentone
Compound characteristics
| Compound ID: | 8020-0186 |
| Compound Name: | 7-benzyl-1,3-dimethylpyrido[3,4-d]pyrimidine-2,4,5,6,8(1H,3H,7H)-pentone |
| Molecular Weight: | 327.29 |
| Molecular Formula: | C16 H13 N3 O5 |
| Smiles: | CN1C2=C(C(C(N(Cc3ccccc3)C2=O)=O)=O)C(N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8957 |
| logD: | 0.8957 |
| logSw: | -1.6692 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 73.88 |
| InChI Key: | YBWFLYIETHMSNL-UHFFFAOYSA-N |