MS4322 (isomer)

cas: 2601727-80-2 — see every product listed under this CAS number, including other names

MS4322 (isomer) (CAS 2601727-80-2) is a chemical reagent available from Chemat. Available pack sizes: 10mg, 1mg, 5mg, 25mg, 50mg, 100mg. Offered by: GLPBio, Chemat.

brandGLPBio
catalog numberGC65876-10
cas2601727-80-2
size10mg
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Available pack sizes

brand size price
GLPBio 10mg 5153.51 Pln
Chemat 1mg 2483.60 Pln
Chemat 5mg 5550.80 Pln
Chemat 10mg 7427.60 Pln
Chemat 25mg 11013.20 Pln
Chemat 50mg 14872.40 Pln
Chemat 100mg 19902.80 Pln

properties

purityNo data
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-6-[[1-[2-[2-[2-[2-[2-[2-[[(2R)-1-[(2S,4R)-4-hydroxy-2-[[(1R)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-2-oxoethoxy]ethoxy]ethoxy]ethoxy]ethoxy]acetyl]azetidin-3-yl]amino]pyrimidine-4-carboxamide (CAS 2601727-80-2) is a chemical compound with the molecular formula C55H76N10O12S and a molecular weight of 1101.3 g/mol. IUPAC name: N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-6-[[1-[2-[2-[2-[2-[2-[2-[[(2R)-1-[(2S,4R)-4-hydroxy-2-[[(1R)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-2-oxoethoxy]ethoxy]ethoxy]ethoxy]ethoxy]acetyl]azetidin-3-yl]amino]pyrimidine-4-carboxamide. InChIKey: XUJMNOQMXWVXQE-FKZVQDAVSA-N.

Identity
Molecular formulaC55H76N10O12S
Molecular weight1101.3 g/mol
IUPAC nameN-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-6-[[1-[2-[2-[2-[2-[2-[2-[[(2R)-1-[(2S,4R)-4-hydroxy-2-[[(1R)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-2-oxoethoxy]ethoxy]ethoxy]ethoxy]ethoxy]acetyl]azetidin-3-yl]amino]pyrimidine-4-carboxamide
InChIKeyXUJMNOQMXWVXQE-FKZVQDAVSA-N
SMILESCC1=C(SC=N1)C2=CC=C(C=C2)[C@@H](C)NC(=O)[C@@H]3C[C@H](CN3C(=O)[C@@H](C(C)(C)C)NC(=O)COCCOCCOCCOCCOCC(=O)N4CC(C4)NC5=NC=NC(=C5)C(=O)NC[C@@H](CN6CCC7=CC=CC=C7C6)O)O

Computed by PubChem (NCBI)

Synonyms: (Iso)-MS4322, orb1690739
Related forms of this compound
N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]-6-[[1-[2-[2-[2-[2-[2-[2-[[(2S)-1-[(2S,4R)-4-hydroxy-2-[[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]carbamoyl]pyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]amino]-2-oxoethoxy]ethoxy]ethoxy]ethoxy]ethoxy]acetyl]azetidin-3-yl]amino]pyrimidine-4-carboxamide C55H76N10O12S

Also listed as

MS4322 (isomer), 98% AmBeed CAS 2601727-80-2
(Iso)-MS4322/ 99.76% (existing batch purity) TargetMol CAS 2601727-80-2
MS4322 (isomer) Chemat CAS 2601727-80-2
MS4322 (isomer), 99.87% MedChemExpress CAS 2601727-80-2