6-ACETYL-8-CYCLOPENTYL-5-METHYL-2-[[5-(1-PIPERAZINYL)-2-PYRIDINYL]AMINO]PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONE 2-HYDROXY-ETHANESULFONIC ACID (1:1)

CAS No.
827022-33-3
CCD No.
CCD07546976
Formula
C24 H29 N7 O2 . C2 H6 O4 S
MolWeight
573.672

Basic Information

Product Name: 6-ACETYL-8-CYCLOPENTYL-5-METHYL-2-[[5-(1-PIPERAZINYL)-2-PYRIDINYL]AMINO]PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONE 2-HYDROXY-ETHANESULFONIC ACID (1:1)
CAS: 827022-33-3
English Synonyms: 6-ACETYL-8-CYCLOPENTYL-5-METHYL-2-[[5-(1-PIPERAZINYL)-2-PYRIDINYL]AMINO]PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONE 2-HYDROXY-ETHANESULFONIC ACID (1:1) ; PALBOCICLIB (PD0332991) ISETHIONATE ; PD 0332991 ISETHIONATE
MDL Number.: MFCD22666589
H bond acceptor: 9
H bond donor: 2
Smile: Cc1c2cnc(nc2n(c(=O)c1C(=O)C)C3CCCC3)Nc4ccc(cn4)N5CCNCC5.C(CS(=O)(=O)O)O
InChi: InChI=1S/C24H29N7O2.C2H6O4S/c1-15-19-14-27-24(28-20-8-7-18(13-26-20)30-11-9-25-10-12-30)29-22(19)31(17-5-3-4-6-17)23(33)21(15)16(2)32;3-1-2-7(4,5)6/h7-8,13-14,17,25H,3-6,9-12H2,1-2H3,(H,26,27,28,29);3H,1-2H2,(H,4,5,6)
InChiKey: InChIKey=LYYVFHRFIJKPOV-UHFFFAOYSA-N

Property

Safety information

Symbol: GHS06 GHS06
Signal word: Danger
Hazard statements: H301
Precautionary statements: P301 + P310
hazard symbol: T
Risk Code: R:25
Safe Code: S:45
WGK Germany: 3

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