N-[(5-chloro-1H-indol-2-yl)methyl]-1-methyl-4-nitro-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
N-[(5-chloro-1H-indol-2-yl)methyl]-1-methyl-4-nitro-1H-pyrazole-3-carboxamide
N-[(5-chloro-1H-indol-2-yl)methyl]-1-methyl-4-nitro-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y501-7715 |
| Compound Name: | N-[(5-chloro-1H-indol-2-yl)methyl]-1-methyl-4-nitro-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 333.73 |
| Molecular Formula: | C14 H12 Cl N5 O3 |
| Smiles: | Cn1cc(c(C(NCc2cc3cc(ccc3[nH]2)[Cl])=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.8582 |
| logD: | 1.8571 |
| logSw: | -2.8886 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.932 |
| InChI Key: | FPKWSPWFXDNLKO-UHFFFAOYSA-N |