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Chemical structure of K-7174

GC10983

K-7174

Also known as 1,4-bis[(E)-5-(3,4,5-trimethoxyphenyl)pent-4-enyl]-1,4-diazepane;dihydrochloride

K-7174 is a novel cell adhesion inhibitor; inhibits the expression of vascular cell adhesion molecule-1 (VCAM-1) induced by either IL-1β or TNF-α

ChemicalCAS191089-60-8MW641.67FormulaC33H50Cl2N2O6
CAS number
191089-60-8
Molecular weight
641.67
Formula
C33H50Cl2N2O6
Solubility
≥ 64·2mg/mL in Water
InChIKey
JKAQFPBRMVEHBD-CHBZAFCASA-N
Catalogue number
GC10983
Brand
GLPBIO
Computed properties PubChem CID 9874190 · TPSA 61.9 Ų · H-bond donors 2 · H-bond acceptors 8
TPSA
61.9 Ų
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
16
Heavy atoms
43

SMILES COC1=CC(=CC(=C1OC)OC)/C=C/CCCN2CCN(CCC2)CCC/C=C/C3=CC(=C(C(=C3)OC)OC)OC.Cl.Cl

Computed descriptors from PubChem (CID 9874190), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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