2-[9-(3-chloro-4-methylphenyl)-1,7-dimethyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetamide
Chemical Structure Depiction of
2-[9-(3-chloro-4-methylphenyl)-1,7-dimethyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetamide
2-[9-(3-chloro-4-methylphenyl)-1,7-dimethyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetamide
Compound characteristics
| Compound ID: | D389-1042 |
| Compound Name: | 2-[9-(3-chloro-4-methylphenyl)-1,7-dimethyl-2,4-dioxo-1,4,6,7,8,9-hexahydropyrimido[2,1-f]purin-3(2H)-yl]acetamide |
| Molecular Weight: | 416.87 |
| Molecular Formula: | C19 H21 Cl N6 O3 |
| Smiles: | CC1CN(c2ccc(C)c(c2)[Cl])c2nc3c(C(N(CC(N)=O)C(N3C)=O)=O)n2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6965 |
| logD: | 2.6964 |
| logSw: | -3.2243 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.309 |
| InChI Key: | CHJPGJOKCYENEE-JTQLQIEISA-N |