(4-methyl-1H-pyrazol-1-yl){5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-yl}methanone
Chemical Structure Depiction of
(4-methyl-1H-pyrazol-1-yl){5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-yl}methanone
(4-methyl-1H-pyrazol-1-yl){5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-yl}methanone
Compound characteristics
| Compound ID: | Y500-3363 |
| Compound Name: | (4-methyl-1H-pyrazol-1-yl){5-[(4-nitro-1H-pyrazol-1-yl)methyl]furan-2-yl}methanone |
| Molecular Weight: | 301.26 |
| Molecular Formula: | C13 H11 N5 O4 |
| Smiles: | Cc1cnn(c1)C(c1ccc(Cn2cc(cn2)[N+]([O-])=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0372 |
| logD: | 1.0372 |
| logSw: | -2.0784 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 83.52 |
| InChI Key: | ZTCFVDNXEABJCE-UHFFFAOYSA-N |