3,12-dihydroxy-24-(2-phenylmorpholin-4-yl)cholan-24-one
Chemical Structure Depiction of
3,12-dihydroxy-24-(2-phenylmorpholin-4-yl)cholan-24-one
3,12-dihydroxy-24-(2-phenylmorpholin-4-yl)cholan-24-one
Compound characteristics
| Compound ID: | Y043-8375 |
| Compound Name: | 3,12-dihydroxy-24-(2-phenylmorpholin-4-yl)cholan-24-one |
| Molecular Weight: | 537.78 |
| Molecular Formula: | C34 H51 N O4 |
| Smiles: | [H][C@@]12C[C@@H]([C@@]3(C)[C@@]([H])(CC[C@]3([H])[C@H](C)CCC(N3CCOC(C3)c3ccccc3)=O)[C@]2([H])CC[C@]2([H])C[C@@H](CC[C@]12C)O)O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8729 |
| logD: | 4.8729 |
| logSw: | -4.7561 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.533 |
| InChI Key: | XRFDMWGHJRKUTA-HUALZFHRSA-N |