6-(3-nitrophenyl)-6,9-dihydropyrido[3,2-e][1,2,4]triazolo[1,5-a]pyrimidine-5,8(4H,7H)-dione
Chemical Structure Depiction of
6-(3-nitrophenyl)-6,9-dihydropyrido[3,2-e][1,2,4]triazolo[1,5-a]pyrimidine-5,8(4H,7H)-dione
6-(3-nitrophenyl)-6,9-dihydropyrido[3,2-e][1,2,4]triazolo[1,5-a]pyrimidine-5,8(4H,7H)-dione
Compound characteristics
| Compound ID: | 8017-2187 |
| Compound Name: | 6-(3-nitrophenyl)-6,9-dihydropyrido[3,2-e][1,2,4]triazolo[1,5-a]pyrimidine-5,8(4H,7H)-dione |
| Molecular Weight: | 326.27 |
| Molecular Formula: | C14 H10 N6 O4 |
| Smiles: | C1C(C2=C(NC1=O)n1c(NC2=O)ncn1)c1cccc(c1)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.3237 |
| logD: | 0.3234 |
| logSw: | -2.2506 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 109.468 |
| InChI Key: | KMBPBQOKEPOJIN-VIFPVBQESA-N |