NSC56742 structure

NSC56742

3-[3-oxo-3-[(2Z)-2-(1,3,4,5,6-pentahydroxyhexan-2-ylidene)hydrazinyl]propyl]sulfanyl-N-[(E)-1,3,4,5,6-pentahydroxyhexan-2-ylideneamino]propanamide

Also Known As: 3-({3-Oxo-3-[(2E)-2-(1,3,4,5,6-pentahydroxyhexan-2-ylidene)hydrazin-1-yl]propyl}sulfanyl)-N'-[(2Z)-1,3,4,5,6-pentahydroxyhexan-2-ylidene]propanehydrazide

CAS: 7148-39-2
Molecular Formula C18H34N4O12S
Molecular Weight 530.1894 g/mol
LogP -6.4212
Topological Polar Surface Area 285.22 Ų
Hydrogen Bond Donors 12
Hydrogen Bond Acceptors 15
Rotatable Bonds 18
Exact Mass 530.1894
Monoisotopic Mass 530.1894
Heavy Atoms 35
Complexity 642.3962

Chemical Identifiers

CAS Number 7148-39-2
SMILES C(CSCCC(=O)N/N=C(/CO)\C(C(C(CO)O)O)O)C(=O)N/N=C(\CO)/C(C(C(CO)O)O)O

Product Overview

NSC56742 (CAS 7148-39-2), with molecular formula C18H34N4O12S and molecular weight 530.1894 g/mol. IUPAC: 3-[3-oxo-3-[(2Z)-2-(1,3,4,5,6-pentahydroxyhexan-2-ylidene)hydrazinyl]propyl]sulfanyl-N-[(E)-1,3,4,5,6-pentahydroxyhexan-2-ylideneamino]propanamide.

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