10-methyl-1-[(4-methylphenyl)methyl]-2,5-dioxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile
Chemical Structure Depiction of
10-methyl-1-[(4-methylphenyl)methyl]-2,5-dioxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile
10-methyl-1-[(4-methylphenyl)methyl]-2,5-dioxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile
Compound characteristics
| Compound ID: | D021-0179 |
| Compound Name: | 10-methyl-1-[(4-methylphenyl)methyl]-2,5-dioxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile |
| Molecular Weight: | 356.38 |
| Molecular Formula: | C21 H16 N4 O2 |
| Smiles: | CC1=CC=CN2C1=NC1=C(C=C(C#N)C(N1Cc1ccc(C)cc1)=O)C2=O |
| Stereo: | ACHIRAL |
| logP: | 2.5833 |
| logD: | 2.5831 |
| logSw: | -2.7167 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.651 |
| InChI Key: | FXUDHMFVWFXDEU-UHFFFAOYSA-N |