N-(3-chloro-2-methylphenyl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
N-(3-chloro-2-methylphenyl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | Y501-5444 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide |
| Molecular Weight: | 360.75 |
| Molecular Formula: | C16 H13 Cl N4 O4 |
| Smiles: | Cc1c(cccc1[Cl])NC(c1ccc(Cn2cc(cn2)[N+]([O-])=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3989 |
| logD: | 3.3968 |
| logSw: | -3.6238 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.36 |
| InChI Key: | DHZGMRJURSIFCU-UHFFFAOYSA-N |