5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)furan-2-carboxamide
Chemical Structure Depiction of
5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)furan-2-carboxamide
5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)furan-2-carboxamide
Compound characteristics
Compound ID: | 6228-1388 |
Compound Name: | 5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-(4-methyl-1,3-benzothiazol-2-yl)furan-2-carboxamide |
Molecular Weight: | 445.34 |
Molecular Formula: | C19 H17 Br N4 O2 S |
Smiles: | Cc1cccc2c1nc(NC(c1ccc(Cn3c(C)c(c(C)n3)[Br])o1)=O)s2 |
Stereo: | ACHIRAL |
logP: | 4.6612 |
logD: | 4.6603 |
logSw: | -4.389 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 55.985 |
InChI Key: | RWIYVFPCCXXEOT-UHFFFAOYSA-N |