ethyl 5-(3-{[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino}-2-hydroxypropoxy)-2-methyl-1-(4-methylphenyl)-1H-indole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(3-{[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino}-2-hydroxypropoxy)-2-methyl-1-(4-methylphenyl)-1H-indole-3-carboxylate
ethyl 5-(3-{[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino}-2-hydroxypropoxy)-2-methyl-1-(4-methylphenyl)-1H-indole-3-carboxylate
Compound characteristics
| Compound ID: | 5936-0108 |
| Compound Name: | ethyl 5-(3-{[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino}-2-hydroxypropoxy)-2-methyl-1-(4-methylphenyl)-1H-indole-3-carboxylate |
| Molecular Weight: | 486.57 |
| Molecular Formula: | C26 H34 N2 O7 |
| Smiles: | CCOC(c1c2cc(ccc2n(c2ccc(C)cc2)c1C)OCC(CNC(CO)(CO)CO)O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2587 |
| logD: | 2.0666 |
| logSw: | -2.8608 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 110.454 |
| InChI Key: | JRTBBEJZMJSDQI-FQEVSTJZSA-N |