methyl 3-(4-methylpiperidine-1-sulfonyl)-2-oxo-2H-1-benzopyran-6-carboxylate
Chemical Structure Depiction of
methyl 3-(4-methylpiperidine-1-sulfonyl)-2-oxo-2H-1-benzopyran-6-carboxylate
methyl 3-(4-methylpiperidine-1-sulfonyl)-2-oxo-2H-1-benzopyran-6-carboxylate
Compound characteristics
| Compound ID: | C200-6190 |
| Compound Name: | methyl 3-(4-methylpiperidine-1-sulfonyl)-2-oxo-2H-1-benzopyran-6-carboxylate |
| Molecular Weight: | 365.4 |
| Molecular Formula: | C17 H19 N O6 S |
| Smiles: | CC1CCN(CC1)S(C1=Cc2cc(ccc2OC1=O)C(=O)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6955 |
| logD: | 2.6955 |
| logSw: | -3.2049 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 74.045 |
| InChI Key: | UEZCPXVLAWHFIN-UHFFFAOYSA-N |