2-(8-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methyl}-3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
Chemical Structure Depiction of
2-(8-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methyl}-3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
2-(8-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methyl}-3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide
Compound characteristics
| Compound ID: | C692-0570 |
| Compound Name: | 2-(8-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methyl}-3-methyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)acetamide |
| Molecular Weight: | 445.91 |
| Molecular Formula: | C20 H24 Cl N7 O3 |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)Cc1nc2c(C(NC(N2C)=O)=O)n1CC(N)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.4279 |
| logD: | 1.4229 |
| logSw: | -2.7962 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 92.946 |
| InChI Key: | SKDWNVRIEWERKC-UHFFFAOYSA-N |