3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-nitro-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-nitro-1-benzothiophene-2-carboxamide
3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-nitro-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | Y500-0897 |
| Compound Name: | 3-chloro-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-nitro-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 390.8 |
| Molecular Formula: | C17 H11 Cl N2 O5 S |
| Smiles: | C1COc2cc(ccc2O1)NC(c1c(c2ccc(cc2s1)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.6884 |
| logD: | 3.6861 |
| logSw: | -4.5073 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.281 |
| InChI Key: | WROJGSXOXUESEF-UHFFFAOYSA-N |