8-methoxy-3-(4-methylpiperazine-1-sulfonyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
8-methoxy-3-(4-methylpiperazine-1-sulfonyl)-2H-1-benzopyran-2-one
8-methoxy-3-(4-methylpiperazine-1-sulfonyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | F312-0115 |
| Compound Name: | 8-methoxy-3-(4-methylpiperazine-1-sulfonyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 338.38 |
| Molecular Formula: | C15 H18 N2 O5 S |
| Smiles: | CN1CCN(CC1)S(C1=Cc2cccc(c2OC1=O)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8731 |
| logD: | 0.7229 |
| logSw: | -2.0647 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 63.662 |
| InChI Key: | PGUZPQFAGOCCJQ-UHFFFAOYSA-N |