N'-{[3-(1-methyl-1H-pyrazol-4-yl)prop-2-enoyl]oxy}-4-nitrobenzene-1-carboximidamide
Chemical Structure Depiction of
N'-{[3-(1-methyl-1H-pyrazol-4-yl)prop-2-enoyl]oxy}-4-nitrobenzene-1-carboximidamide
N'-{[3-(1-methyl-1H-pyrazol-4-yl)prop-2-enoyl]oxy}-4-nitrobenzene-1-carboximidamide
Compound characteristics
| Compound ID: | Y501-7042 |
| Compound Name: | N'-{[3-(1-methyl-1H-pyrazol-4-yl)prop-2-enoyl]oxy}-4-nitrobenzene-1-carboximidamide |
| Molecular Weight: | 315.29 |
| Molecular Formula: | C14 H13 N5 O4 |
| Smiles: | Cn1cc(/C=C/C(=O)O/N=C(/c2ccc(cc2)[N+]([O-])=O)N)cn1 |
| Stereo: | ACHIRAL |
| logP: | 1.0491 |
| logD: | 1.0491 |
| logSw: | -2.0374 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.705 |
| InChI Key: | PHRLFJUGJFKNOG-UHFFFAOYSA-N |