N-{3-[(2,3-dihydro-1H-inden-5-yl)oxy]-5-nitrophenyl}-5-ethylthiophene-3-carboxamide
Chemical Structure Depiction of
N-{3-[(2,3-dihydro-1H-inden-5-yl)oxy]-5-nitrophenyl}-5-ethylthiophene-3-carboxamide
N-{3-[(2,3-dihydro-1H-inden-5-yl)oxy]-5-nitrophenyl}-5-ethylthiophene-3-carboxamide
Compound characteristics
| Compound ID: | Y501-3157 |
| Compound Name: | N-{3-[(2,3-dihydro-1H-inden-5-yl)oxy]-5-nitrophenyl}-5-ethylthiophene-3-carboxamide |
| Molecular Weight: | 408.47 |
| Molecular Formula: | C22 H20 N2 O4 S |
| Smiles: | CCc1cc(cs1)C(Nc1cc(cc(c1)Oc1ccc2CCCc2c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2963 |
| logD: | 6.2946 |
| logSw: | -5.3718 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.764 |
| InChI Key: | VECMUSVWDBHLQF-UHFFFAOYSA-N |