1-(2,3-dihydro-1H-indol-1-yl)-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butan-1-one
Chemical Structure Depiction of
1-(2,3-dihydro-1H-indol-1-yl)-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butan-1-one
1-(2,3-dihydro-1H-indol-1-yl)-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butan-1-one
Compound characteristics
| Compound ID: | 8016-7296 |
| Compound Name: | 1-(2,3-dihydro-1H-indol-1-yl)-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butan-1-one |
| Molecular Weight: | 328.37 |
| Molecular Formula: | C17 H20 N4 O3 |
| Smiles: | Cc1c(c(C)n(CCCC(N2CCc3ccccc23)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.9278 |
| logD: | 1.9278 |
| logSw: | -2.0683 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.701 |
| InChI Key: | NBXCZYGOTYWRQY-UHFFFAOYSA-N |