N-[(1-ethyl-1H-pyrazol-3-yl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-3-nitrobenzene-1-sulfonamide
Chemical Structure Depiction of
N-[(1-ethyl-1H-pyrazol-3-yl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-3-nitrobenzene-1-sulfonamide
N-[(1-ethyl-1H-pyrazol-3-yl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-3-nitrobenzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y501-4117 |
| Compound Name: | N-[(1-ethyl-1H-pyrazol-3-yl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-3-nitrobenzene-1-sulfonamide |
| Molecular Weight: | 453.52 |
| Molecular Formula: | C22 H23 N5 O4 S |
| Smiles: | CCn1ccc(CN(CCc2c[nH]c3ccccc23)S(c2cccc(c2)[N+]([O-])=O)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.3518 |
| logD: | 3.3518 |
| logSw: | -3.6901 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.453 |
| InChI Key: | YNJFLMKQDNDCHC-UHFFFAOYSA-N |