4-({[2-(naphthalen-2-yl)-1,3-benzoxazol-5-yl]imino}methyl)phenyl 3-bromobenzoate
Chemical Structure Depiction of
4-({[2-(naphthalen-2-yl)-1,3-benzoxazol-5-yl]imino}methyl)phenyl 3-bromobenzoate
4-({[2-(naphthalen-2-yl)-1,3-benzoxazol-5-yl]imino}methyl)phenyl 3-bromobenzoate
Compound characteristics
Compound ID: | 0850-0225 |
Compound Name: | 4-({[2-(naphthalen-2-yl)-1,3-benzoxazol-5-yl]imino}methyl)phenyl 3-bromobenzoate |
Molecular Weight: | 547.41 |
Molecular Formula: | C31 H19 Br N2 O3 |
Smiles: | C(\c1ccc(cc1)OC(c1cccc(c1)[Br])=O)=N/c1ccc2c(c1)nc(c1ccc3ccccc3c1)o2 |
Stereo: | ACHIRAL |
logP: | 7.6903 |
logD: | 7.69 |
logSw: | -7.0222 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 45.282 |
InChI Key: | BBLSEROAMJOVMV-UHFFFAOYSA-N |