1,5-dimethyl-4-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
1,5-dimethyl-4-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
1,5-dimethyl-4-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 3660-0260 |
| Compound Name: | 1,5-dimethyl-4-[(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]-2-phenyl-1,2-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 366.33 |
| Molecular Formula: | C17 H14 N6 O4 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)Nc1ccc2c(c1[N+]([O-])=O)non2 |
| Stereo: | ACHIRAL |
| logP: | 2.5012 |
| logD: | 0.092 |
| logSw: | -2.6942 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.704 |
| InChI Key: | LTAHAGBSAFOMDB-UHFFFAOYSA-N |