1-{5-[3-(benzylamino)-2-hydroxypropoxy]-2-methyl-1-(4-methylphenyl)-1H-indol-3-yl}ethan-1-one
Chemical Structure Depiction of
1-{5-[3-(benzylamino)-2-hydroxypropoxy]-2-methyl-1-(4-methylphenyl)-1H-indol-3-yl}ethan-1-one
1-{5-[3-(benzylamino)-2-hydroxypropoxy]-2-methyl-1-(4-methylphenyl)-1H-indol-3-yl}ethan-1-one
Compound characteristics
| Compound ID: | D016-0524 |
| Compound Name: | 1-{5-[3-(benzylamino)-2-hydroxypropoxy]-2-methyl-1-(4-methylphenyl)-1H-indol-3-yl}ethan-1-one |
| Molecular Weight: | 442.56 |
| Molecular Formula: | C28 H30 N2 O3 |
| Smiles: | CC(c1c2cc(ccc2n(c2ccc(C)cc2)c1C)OCC(CNCc1ccccc1)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7736 |
| logD: | 3.6797 |
| logSw: | -4.6642 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.893 |
| InChI Key: | QULMBOCHDAQTCO-DEOSSOPVSA-N |