CAS
12223-37-9 Purity
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12223-37-9 Purity
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Specification
PubChem CID: 66486
Molecular Formula: C22H18N2O5S
Molecular Weight: 422.5 g/mol
IUPAC Name: N-(4-amino-3-methoxy-9,10-dioxoanthracen-1-yl)-4-methylbenzenesulfonamide
InChI: InChI=1S/C22H18N2O5S/c1-12-7-9-13(10-8-12)30(27,28)24-16-11-17(29-2)20(23)19-18(16)21(25)14-5-3-4-6-15(14)22(19)26/h3-11,24H,23H2,1-2H3
InChIKey: BXIGAWRFDMDLTL-UHFFFAOYSA-N
Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)OC
CAS: 81-68-5
ChEMBL ID: CHEMBL2132037
XLogP3-AA value: 4.1