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Chemical structure of Sch-42495 racemate

GC31318

Sch-42495 racemate

Also known as ethyl (2S)-2-[[2-(acetylsulfanylmethyl)-3-(2-methylphenyl)propanoyl]amino]-4-methylsulfanylbutanoate

Sch-42495 racemate is the racemate of SCH 42495

ChemicalCAS145841-10-7MW411.58FormulaC20H29NO4S2
CAS number
145841-10-7
Molecular weight
411.58
Formula
C20H29NO4S2
Solubility
Soluble in DMSO
InChIKey
ZVQXPUMRSJGLSF-ZVAWYAOSSA-N
Catalogue number
GC31318
Brand
GLPBIO
Computed properties PubChem CID 11856583 · XLogP 3.6 · TPSA 123 Ų · H-bond donors 1
XLogP
3.6
TPSA
123 Ų
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
13
Heavy atoms
27

SMILES CCOC(=O)[C@H](CCSC)NC(=O)C(CC1=CC=CC=C1C)CSC(=O)C

Computed descriptors from PubChem (CID 11856583), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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