5,6-dibromocholestan-3-yl 3-methylpentanoate
Chemical Structure Depiction of
5,6-dibromocholestan-3-yl 3-methylpentanoate
5,6-dibromocholestan-3-yl 3-methylpentanoate
Compound characteristics
| Compound ID: | 0242-0993 |
| Compound Name: | 5,6-dibromocholestan-3-yl 3-methylpentanoate |
| Molecular Weight: | 644.62 |
| Molecular Formula: | C33 H56 Br2 O2 |
| Smiles: | CCC(C)CC(=O)OC1CCC2(C)C3CCC4(C)C(CCC4C3CC(C2(C1)[Br])[Br])C(C)CCCC(C)C |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 10.142 |
| logD: | 10.142 |
| logSw: | -5.9176 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.1266 |
| InChI Key: | MYLPOKATQGVMSF-UHFFFAOYSA-N |