3-chloro-N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N-methyl-6-nitro-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N-methyl-6-nitro-1-benzothiophene-2-carboxamide
3-chloro-N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N-methyl-6-nitro-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | Y204-5686 |
| Compound Name: | 3-chloro-N-[(1,3-dimethyl-1H-pyrazol-4-yl)methyl]-N-methyl-6-nitro-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 378.83 |
| Molecular Formula: | C16 H15 Cl N4 O3 S |
| Smiles: | Cc1c(CN(C)C(c2c(c3ccc(cc3s2)[N+]([O-])=O)[Cl])=O)cn(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.0486 |
| logD: | 3.0486 |
| logSw: | -3.7621 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 65.679 |
| InChI Key: | ZZWNLDZZBLNAAT-UHFFFAOYSA-N |