rel-(3R,4R)-4-benzamidothiolan-3-yl 4-bromobenzoate
Chemical Structure Depiction of
rel-(3R,4R)-4-benzamidothiolan-3-yl 4-bromobenzoate
rel-(3R,4R)-4-benzamidothiolan-3-yl 4-bromobenzoate
Compound characteristics
| Compound ID: | 8019-1885 |
| Compound Name: | rel-(3R,4R)-4-benzamidothiolan-3-yl 4-bromobenzoate |
| Molecular Weight: | 406.3 |
| Molecular Formula: | C18 H16 Br N O3 S |
| Smiles: | C1[C@H]([C@@H](CS1)OC(c1ccc(cc1)[Br])=O)NC(c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.0453 |
| logD: | 4.0453 |
| logSw: | -4.2871 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.968 |
| InChI Key: | JAFCXLJLZNJFAE-HOTGVXAUSA-N |