2-(4-bromoanilino)-2-oxoethyl N-benzoylmethioninate
Chemical Structure Depiction of
2-(4-bromoanilino)-2-oxoethyl N-benzoylmethioninate
2-(4-bromoanilino)-2-oxoethyl N-benzoylmethioninate
Compound characteristics
Compound ID: | 8006-2479 |
Compound Name: | 2-(4-bromoanilino)-2-oxoethyl N-benzoylmethioninate |
Molecular Weight: | 465.36 |
Molecular Formula: | C20 H21 Br N2 O4 S |
Smiles: | CSCCC(C(=O)OCC(Nc1ccc(cc1)[Br])=O)NC(c1ccccc1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.5123 |
logD: | 3.5122 |
logSw: | -3.7284 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 68.561 |
InChI Key: | SRNWHQOFQLTSIX-KRWDZBQOSA-N |