4-(2-{3-methyl-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazinyl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-(2-{3-methyl-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazinyl)benzene-1-sulfonamide
4-(2-{3-methyl-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazinyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 1697-1437 |
| Compound Name: | 4-(2-{3-methyl-1-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazinyl)benzene-1-sulfonamide |
| Molecular Weight: | 485.5 |
| Molecular Formula: | C19 H15 N7 O5 S2 |
| Smiles: | CC1\C(C(N(c2nc(cs2)c2cccc(c2)[N+]([O-])=O)N=1)=O)=N/Nc1ccc(cc1)S(N)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.335 |
| logD: | 3.3339 |
| logSw: | -3.8719 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 139.095 |
| InChI Key: | JTMBGKWZPKKMLH-UHFFFAOYSA-N |