2-[(2,5-dimethylphenyl)imino]-8-ethoxy-N-(1,3-thiazol-2-yl)-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
2-[(2,5-dimethylphenyl)imino]-8-ethoxy-N-(1,3-thiazol-2-yl)-2H-1-benzopyran-3-carboxamide
2-[(2,5-dimethylphenyl)imino]-8-ethoxy-N-(1,3-thiazol-2-yl)-2H-1-benzopyran-3-carboxamide
Compound characteristics
Compound ID: | K218-1437 |
Compound Name: | 2-[(2,5-dimethylphenyl)imino]-8-ethoxy-N-(1,3-thiazol-2-yl)-2H-1-benzopyran-3-carboxamide |
Molecular Weight: | 419.5 |
Molecular Formula: | C23 H21 N3 O3 S |
Smiles: | CCOc1cccc2C=C(/C(=N/c3cc(C)ccc3C)Oc12)C(Nc1nccs1)=O |
Stereo: | ACHIRAL |
logP: | 5.0943 |
logD: | 5.07 |
logSw: | -4.8614 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.711 |
InChI Key: | SNICYHPYEHSDLO-UHFFFAOYSA-N |