7-methoxy-N-{5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl}-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
7-methoxy-N-{5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl}-1-benzoxepine-4-carboxamide
7-methoxy-N-{5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl}-1-benzoxepine-4-carboxamide
Compound characteristics
Compound ID: | D443-0778 |
Compound Name: | 7-methoxy-N-{5-[(3-methylphenyl)methyl]-1,3-thiazol-2-yl}-1-benzoxepine-4-carboxamide |
Molecular Weight: | 404.49 |
Molecular Formula: | C23 H20 N2 O3 S |
Smiles: | Cc1cccc(Cc2cnc(NC(C3C=COc4ccc(cc4C=3)OC)=O)s2)c1 |
Stereo: | ACHIRAL |
logP: | 6.2235 |
logD: | 6.2198 |
logSw: | -5.3382 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 46.794 |
InChI Key: | AEYQJYKNYUERKY-UHFFFAOYSA-N |