N-[(4-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-9H-purin-9-yl)acetamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-9H-purin-9-yl)acetamide
N-[(4-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-9H-purin-9-yl)acetamide
Compound characteristics
| Compound ID: | 8016-9760 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-9H-purin-9-yl)acetamide |
| Molecular Weight: | 361.79 |
| Molecular Formula: | C16 H16 Cl N5 O3 |
| Smiles: | CN1C(c2c(N(C)C1=O)n(CC(NCc1ccc(cc1)[Cl])=O)cn2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2742 |
| logD: | 1.2742 |
| logSw: | -2.662 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.376 |
| InChI Key: | BLLRNBVIHAENOR-UHFFFAOYSA-N |