2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(2-methyl-3-nitrophenyl)acetamide
Chemical Structure Depiction of
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(2-methyl-3-nitrophenyl)acetamide
2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(2-methyl-3-nitrophenyl)acetamide
Compound characteristics
| Compound ID: | Y032-0733 |
| Compound Name: | 2-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)-N-(2-methyl-3-nitrophenyl)acetamide |
| Molecular Weight: | 372.34 |
| Molecular Formula: | C16 H16 N6 O5 |
| Smiles: | Cc1c(cccc1[N+]([O-])=O)NC(Cn1cnc2c1C(N(C)C(N2C)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.944 |
| logD: | 0.9418 |
| logSw: | -2.3114 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.493 |
| InChI Key: | ZRHBSDIUOKBCAX-UHFFFAOYSA-N |