6-bromo-3-chloro-N-(2-methoxy-5-nitrophenyl)-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
6-bromo-3-chloro-N-(2-methoxy-5-nitrophenyl)-1-benzothiophene-2-carboxamide
6-bromo-3-chloro-N-(2-methoxy-5-nitrophenyl)-1-benzothiophene-2-carboxamide
Compound characteristics
Compound ID: | Y205-8443 |
Compound Name: | 6-bromo-3-chloro-N-(2-methoxy-5-nitrophenyl)-1-benzothiophene-2-carboxamide |
Molecular Weight: | 441.69 |
Molecular Formula: | C16 H10 Br Cl N2 O4 S |
Smiles: | COc1ccc(cc1NC(c1c(c2ccc(cc2s1)[Br])[Cl])=O)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 5.3394 |
logD: | 4.7255 |
logSw: | -5.9935 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 64.391 |
InChI Key: | TUQTUIQSFARRJQ-UHFFFAOYSA-N |