N-(2-methyl-4-nitrophenyl)-4-{2-[(5-nitrothiophen-2-yl)methylidene]hydrazinyl}-4-oxobutanamide
Chemical Structure Depiction of
N-(2-methyl-4-nitrophenyl)-4-{2-[(5-nitrothiophen-2-yl)methylidene]hydrazinyl}-4-oxobutanamide
N-(2-methyl-4-nitrophenyl)-4-{2-[(5-nitrothiophen-2-yl)methylidene]hydrazinyl}-4-oxobutanamide
Compound characteristics
| Compound ID: | Y508-7525 |
| Compound Name: | N-(2-methyl-4-nitrophenyl)-4-{2-[(5-nitrothiophen-2-yl)methylidene]hydrazinyl}-4-oxobutanamide |
| Molecular Weight: | 405.39 |
| Molecular Formula: | C16 H15 N5 O6 S |
| Smiles: | Cc1cc(ccc1NC(CCC(N/N=C/c1ccc([N+]([O-])=O)s1)=O)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.3973 |
| logD: | 2.3916 |
| logSw: | -2.8687 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 125.925 |
| InChI Key: | UISQBPNPCHKBNU-UHFFFAOYSA-N |