N-(4-chloro-3-nitrophenyl)-4-{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]methyl}benzamide
Chemical Structure Depiction of
N-(4-chloro-3-nitrophenyl)-4-{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]methyl}benzamide
N-(4-chloro-3-nitrophenyl)-4-{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]methyl}benzamide
Compound characteristics
| Compound ID: | F217-0431 |
| Compound Name: | N-(4-chloro-3-nitrophenyl)-4-{[(2,2-dimethyl-2,3-dihydro-1-benzofuran-7-yl)oxy]methyl}benzamide |
| Molecular Weight: | 452.89 |
| Molecular Formula: | C24 H21 Cl N2 O5 |
| Smiles: | CC1(C)Cc2cccc(c2O1)OCc1ccc(cc1)C(Nc1ccc(c(c1)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.4138 |
| logD: | 4.628 |
| logSw: | -6.0109 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.107 |
| InChI Key: | OIEKLXHVMQMAEW-UHFFFAOYSA-N |