N-[(3,4-dimethoxyphenyl)methyl]-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide
Chemical Structure Depiction of
N-[(3,4-dimethoxyphenyl)methyl]-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide
N-[(3,4-dimethoxyphenyl)methyl]-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide
Compound characteristics
| Compound ID: | 8017-0454 |
| Compound Name: | N-[(3,4-dimethoxyphenyl)methyl]-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butanamide |
| Molecular Weight: | 376.41 |
| Molecular Formula: | C18 H24 N4 O5 |
| Smiles: | Cc1c(c(C)n(CCCC(NCc2ccc(c(c2)OC)OC)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.7456 |
| logD: | 0.7456 |
| logSw: | -2.1408 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.011 |
| InChI Key: | DLKJFCQEVVIHCX-UHFFFAOYSA-N |