N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2-(4-bromophenoxy)-2-methylpropanamide
Chemical Structure Depiction of
N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2-(4-bromophenoxy)-2-methylpropanamide
N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2-(4-bromophenoxy)-2-methylpropanamide
Compound characteristics
Compound ID: | 8377-1503 |
Compound Name: | N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2-(4-bromophenoxy)-2-methylpropanamide |
Molecular Weight: | 481.41 |
Molecular Formula: | C24 H21 Br N2 O2 S |
Smiles: | Cc1c(cccc1NC(C(C)(C)Oc1ccc(cc1)[Br])=O)c1nc2ccccc2s1 |
Stereo: | ACHIRAL |
logP: | 6.8843 |
logD: | 6.8842 |
logSw: | -5.8535 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 38.3 |
InChI Key: | FYJPDULEJNIHDB-UHFFFAOYSA-N |