N-(5-ethyl-1,3,4-thiadiazol-2-yl)-7-methoxy-1-benzoxepine-4-carboxamide
Chemical Structure Depiction of
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-7-methoxy-1-benzoxepine-4-carboxamide
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-7-methoxy-1-benzoxepine-4-carboxamide
Compound characteristics
Compound ID: | D443-0787 |
Compound Name: | N-(5-ethyl-1,3,4-thiadiazol-2-yl)-7-methoxy-1-benzoxepine-4-carboxamide |
Molecular Weight: | 329.38 |
Molecular Formula: | C16 H15 N3 O3 S |
Smiles: | CCc1nnc(NC(C2C=COc3ccc(cc3C=2)OC)=O)s1 |
Stereo: | ACHIRAL |
logP: | 3.7764 |
logD: | 3.6557 |
logSw: | -4.0514 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.538 |
InChI Key: | OKRZQJIGPAZCLX-UHFFFAOYSA-N |