N-(4,5-dimethyl-1,3-thiazol-2-yl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
Chemical Structure Depiction of
N-(4,5-dimethyl-1,3-thiazol-2-yl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
N-(4,5-dimethyl-1,3-thiazol-2-yl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide
Compound characteristics
| Compound ID: | Y500-6289 |
| Compound Name: | N-(4,5-dimethyl-1,3-thiazol-2-yl)-5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-carboxamide |
| Molecular Weight: | 347.35 |
| Molecular Formula: | C14 H13 N5 O4 S |
| Smiles: | Cc1c(C)sc(NC(c2ccc(Cn3cc(cn3)[N+]([O-])=O)o2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.446 |
| logD: | 2.0419 |
| logSw: | -2.7645 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.681 |
| InChI Key: | ILIBGORPQPXWRH-UHFFFAOYSA-N |