2-amino-7-(3-nitrophenyl)-6,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5(4H)-one
Chemical Structure Depiction of
2-amino-7-(3-nitrophenyl)-6,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5(4H)-one
2-amino-7-(3-nitrophenyl)-6,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5(4H)-one
Compound characteristics
| Compound ID: | 4826-0435 |
| Compound Name: | 2-amino-7-(3-nitrophenyl)-6,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidin-5(4H)-one |
| Molecular Weight: | 274.24 |
| Molecular Formula: | C11 H10 N6 O3 |
| Smiles: | C1C(c2cccc(c2)[N+]([O-])=O)n2c(NC1=O)nc(N)n2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.574 |
| logD: | 0.5739 |
| logSw: | -2.2418 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 105.158 |
| InChI Key: | IXPSFQQUYGIBDI-QMMMGPOBSA-N |