2-(5-chloro-2-hydroxyphenyl)-5-(3-nitrobenzoyl)-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-(5-chloro-2-hydroxyphenyl)-5-(3-nitrobenzoyl)-1H-isoindole-1,3(2H)-dione
2-(5-chloro-2-hydroxyphenyl)-5-(3-nitrobenzoyl)-1H-isoindole-1,3(2H)-dione
Compound characteristics
Compound ID: | 3226-1504 |
Compound Name: | 2-(5-chloro-2-hydroxyphenyl)-5-(3-nitrobenzoyl)-1H-isoindole-1,3(2H)-dione |
Molecular Weight: | 422.78 |
Molecular Formula: | C21 H11 Cl N2 O6 |
Smiles: | c1cc(cc(c1)[N+]([O-])=O)C(c1ccc2C(N(C(c2c1)=O)c1cc(ccc1O)[Cl])=O)=O |
Stereo: | ACHIRAL |
logP: | 4.7527 |
logD: | 3.7177 |
logSw: | -4.7461 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 91.976 |
InChI Key: | FWJVMLVINGZCCY-UHFFFAOYSA-N |