N-[4-amino-6-(3,4-dimethylanilino)-5-nitropyrimidin-2-yl]glycine
Chemical Structure Depiction of
N-[4-amino-6-(3,4-dimethylanilino)-5-nitropyrimidin-2-yl]glycine
N-[4-amino-6-(3,4-dimethylanilino)-5-nitropyrimidin-2-yl]glycine
Compound characteristics
| Compound ID: | G786-0112 |
| Compound Name: | N-[4-amino-6-(3,4-dimethylanilino)-5-nitropyrimidin-2-yl]glycine |
| Molecular Weight: | 332.32 |
| Molecular Formula: | C14 H16 N6 O4 |
| Smiles: | Cc1ccc(cc1C)Nc1c(c(N)nc(NCC(O)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.9782 |
| logD: | -1.819 |
| logSw: | -2.5111 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 121.862 |
| InChI Key: | YYSVFPALDQAOGI-UHFFFAOYSA-N |