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Chemical structure of Dehydrocyclopeptine

GC43402

Dehydrocyclopeptine

Also known as 3-benzylidene-4-methyl-1H-1,4-benzodiazepine-2,5-dione

Dehydrocyclopeptine is an intermediate in the synthesis of benzodiazepine alkaloids in Penicillium

ChemicalCAS31965-37-4MW278.3FormulaC17H14N2O2
CAS number
31965-37-4
Molecular weight
278.3
Formula
C17H14N2O2
Solubility
Soluble in DMSO
InChIKey
FYVKHLSOIIPVEH-UHFFFAOYSA-N
Catalogue number
GC43402
Brand
GLPBIO
Computed properties PubChem CID 92282 · XLogP 2.5 · TPSA 49.4 Ų · H-bond donors 1
XLogP
2.5
TPSA
49.4 Ų
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
21

SMILES CN1C(=CC2=CC=CC=C2)C(=O)NC3=CC=CC=C3C1=O

Computed descriptors from PubChem (CID 92282), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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