3-(4-benzylpiperidine-1-sulfonyl)-8-methoxy-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(4-benzylpiperidine-1-sulfonyl)-8-methoxy-2H-1-benzopyran-2-one
3-(4-benzylpiperidine-1-sulfonyl)-8-methoxy-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | F312-0180 |
| Compound Name: | 3-(4-benzylpiperidine-1-sulfonyl)-8-methoxy-2H-1-benzopyran-2-one |
| Molecular Weight: | 413.49 |
| Molecular Formula: | C22 H23 N O5 S |
| Smiles: | COc1cccc2C=C(C(=O)Oc12)S(N1CCC(CC1)Cc1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0833 |
| logD: | 4.0833 |
| logSw: | -4.4202 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 59.914 |
| InChI Key: | AGUWFLQADFENQQ-UHFFFAOYSA-N |