phenyl (3-acetyl-2-methyl-1-benzofuran-5-yl)(3-nitrobenzene-1-sulfonyl)carbamate
Chemical Structure Depiction of
phenyl (3-acetyl-2-methyl-1-benzofuran-5-yl)(3-nitrobenzene-1-sulfonyl)carbamate
phenyl (3-acetyl-2-methyl-1-benzofuran-5-yl)(3-nitrobenzene-1-sulfonyl)carbamate
Compound characteristics
| Compound ID: | 5591-0010 |
| Compound Name: | phenyl (3-acetyl-2-methyl-1-benzofuran-5-yl)(3-nitrobenzene-1-sulfonyl)carbamate |
| Molecular Weight: | 494.48 |
| Molecular Formula: | C24 H18 N2 O8 S |
| Smiles: | CC(c1c2cc(ccc2oc1C)N(C(=O)Oc1ccccc1)S(c1cccc(c1)[N+]([O-])=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.629 |
| logD: | 4.629 |
| logSw: | -4.7021 |
| Hydrogen bond acceptors count: | 14 |
| Polar surface area: | 106.65 |
| InChI Key: | PUECTSGGWPAJDV-UHFFFAOYSA-N |