N-(4-nitrophenyl)-1,3-dioxo-2-(1,3-thiazol-2-yl)-2,3-dihydro-1H-isoindole-5-carboxamide
Chemical Structure Depiction of
N-(4-nitrophenyl)-1,3-dioxo-2-(1,3-thiazol-2-yl)-2,3-dihydro-1H-isoindole-5-carboxamide
N-(4-nitrophenyl)-1,3-dioxo-2-(1,3-thiazol-2-yl)-2,3-dihydro-1H-isoindole-5-carboxamide
Compound characteristics
Compound ID: | 8005-9390 |
Compound Name: | N-(4-nitrophenyl)-1,3-dioxo-2-(1,3-thiazol-2-yl)-2,3-dihydro-1H-isoindole-5-carboxamide |
Molecular Weight: | 394.36 |
Molecular Formula: | C18 H10 N4 O5 S |
Smiles: | c1cc2C(N(C(c2cc1C(Nc1ccc(cc1)[N+]([O-])=O)=O)=O)c1nccs1)=O |
Stereo: | ACHIRAL |
logP: | 3.004 |
logD: | 2.6067 |
logSw: | -3.8055 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 95.605 |
InChI Key: | WLRGUDHIWFPIRA-UHFFFAOYSA-N |