6-bromo-3-(4-methylpiperazine-1-sulfonyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-bromo-3-(4-methylpiperazine-1-sulfonyl)-2H-1-benzopyran-2-one
6-bromo-3-(4-methylpiperazine-1-sulfonyl)-2H-1-benzopyran-2-one
Compound characteristics
Compound ID: | F312-0118 |
Compound Name: | 6-bromo-3-(4-methylpiperazine-1-sulfonyl)-2H-1-benzopyran-2-one |
Molecular Weight: | 387.25 |
Molecular Formula: | C14 H15 Br N2 O4 S |
Smiles: | CN1CCN(CC1)S(C1=Cc2cc(ccc2OC1=O)[Br])(=O)=O |
Stereo: | ACHIRAL |
logP: | 1.6636 |
logD: | 1.5134 |
logSw: | -2.5211 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 56.348 |
InChI Key: | RLYJJRZYBKUXNH-UHFFFAOYSA-N |