7-(4-nitrophenyl)-4H-[1,2,5]oxadiazolo[3,4-b][1,4]diazepin-5(8H)-one
Chemical Structure Depiction of
7-(4-nitrophenyl)-4H-[1,2,5]oxadiazolo[3,4-b][1,4]diazepin-5(8H)-one
7-(4-nitrophenyl)-4H-[1,2,5]oxadiazolo[3,4-b][1,4]diazepin-5(8H)-one
Compound characteristics
| Compound ID: | 8006-0413 |
| Compound Name: | 7-(4-nitrophenyl)-4H-[1,2,5]oxadiazolo[3,4-b][1,4]diazepin-5(8H)-one |
| Molecular Weight: | 273.2 |
| Molecular Formula: | C11 H7 N5 O4 |
| Smiles: | C1=C(c2ccc(cc2)[N+]([O-])=O)Nc2c(NC1=O)non2 |
| Stereo: | ACHIRAL |
| logP: | 2.2742 |
| logD: | -2.0426 |
| logSw: | -2.9337 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.79 |
| InChI Key: | RXFDXRUXTWWMQG-UHFFFAOYSA-N |