Name: MS159
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HIT ID:HIT218671664
Cas No:3031353-59-7
Common Name:MS159
IUPAC:N-cyclopropyl-N-{[4-({5-[3-(2-{[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl]amino}acetamido)propoxy]pyridin-2-yl}carbamoyl)phenyl]methyl}-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-carboxamide
IUPAC:N-cyclopropyl-N-{[4-({5-[3-(2-{[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxo-2,3-dihydro-1H-isoindol-4-yl]amino}acetamido)propoxy]pyridin-2-yl}carbamoyl)phenyl]methyl}-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-7-carboxamide
InChIKey:OBZWKPGPTCBYOS-UHFFFAOYSA-N

Molecular Formula:C43H40N8O10
Molecular Weight:828.839
Hydrogen Bond Donor (HBD):
Hydrogen Bond Acceptor (HBA):
LogP:
SMILES:O=C(CNc1cccc2C(=O)N(C3CCC(=O)NC3=O)C(=O)c12)NCCCOc1ccc(NC(=O)c2ccc(CN(C3CC3)C(=O)c3ccc4NC(=O)COc4c3)cc2)nc1
SMILES:O=C(CNc1cccc2C(=O)N(C3CCC(=O)NC3=O)C(=O)c12)NCCCOc1ccc(NC(=O)c2ccc(CN(C3CC3)C(=O)c3ccc4NC(=O)COc4c3)cc2)nc1

MS159 is a potent PROTAC degrader targeting the nuclear receptor binding SET structural domain protein 2 (NSD2), which inhibits tumor cell growth. This compound serves as a valuable chemical tool for investigating NSD2's function in health and disease [1].

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