2-bromo-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]benzamide
Chemical Structure Depiction of
2-bromo-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]benzamide
2-bromo-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]benzamide
Compound characteristics
Compound ID: | 0934-0115 |
Compound Name: | 2-bromo-N-[4-(4-nitrophenyl)-1,3-thiazol-2-yl]benzamide |
Molecular Weight: | 404.24 |
Molecular Formula: | C16 H10 Br N3 O3 S |
Smiles: | c1ccc(c(c1)C(Nc1nc(cs1)c1ccc(cc1)[N+]([O-])=O)=O)[Br] |
Stereo: | ACHIRAL |
logP: | 4.8732 |
logD: | 4.8678 |
logSw: | -4.9695 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 66.486 |
InChI Key: | BBYJPHKYTVQKFJ-UHFFFAOYSA-N |