5-bromo-1-butyl-3-hydroxy-3-(2-oxo-2-phenylethyl)-1,3-dihydro-2H-indol-2-one
Chemical Structure Depiction of
5-bromo-1-butyl-3-hydroxy-3-(2-oxo-2-phenylethyl)-1,3-dihydro-2H-indol-2-one
5-bromo-1-butyl-3-hydroxy-3-(2-oxo-2-phenylethyl)-1,3-dihydro-2H-indol-2-one
Compound characteristics
| Compound ID: | 5056-0041 |
| Compound Name: | 5-bromo-1-butyl-3-hydroxy-3-(2-oxo-2-phenylethyl)-1,3-dihydro-2H-indol-2-one |
| Molecular Weight: | 402.29 |
| Molecular Formula: | C20 H20 Br N O3 |
| Smiles: | CCCCN1C(C(CC(c2ccccc2)=O)(c2cc(ccc12)[Br])O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9717 |
| logD: | 3.9717 |
| logSw: | -4.0255 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.293 |
| InChI Key: | YYGNVQOGNBZYBJ-FQEVSTJZSA-N |