2-{3-[(4-nitro-1H-pyrazol-1-yl)methyl]benzamido}-5-(propan-2-yl)thiophene-3-carboxamide
Chemical Structure Depiction of
2-{3-[(4-nitro-1H-pyrazol-1-yl)methyl]benzamido}-5-(propan-2-yl)thiophene-3-carboxamide
2-{3-[(4-nitro-1H-pyrazol-1-yl)methyl]benzamido}-5-(propan-2-yl)thiophene-3-carboxamide
Compound characteristics
| Compound ID: | Y501-7824 |
| Compound Name: | 2-{3-[(4-nitro-1H-pyrazol-1-yl)methyl]benzamido}-5-(propan-2-yl)thiophene-3-carboxamide |
| Molecular Weight: | 413.45 |
| Molecular Formula: | C19 H19 N5 O4 S |
| Smiles: | CC(C)c1cc(C(N)=O)c(NC(c2cccc(Cn3cc(cn3)[N+]([O-])=O)c2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.2841 |
| logD: | 1.2193 |
| logSw: | -3.108 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 105.07 |
| InChI Key: | WNRVYGYURWEWBW-UHFFFAOYSA-N |