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Chemical structure of Cyclopeptine

GC43348

Cyclopeptine

Also known as (3S)-3-benzyl-4-methyl-1,3-dihydro-1,4-benzodiazepine-2,5-dione

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

ChemicalCAS50886-63-0MW280.3FormulaC17H16N2O2
CAS number
50886-63-0
Molecular weight
280.3
Formula
C17H16N2O2
Solubility
Soluble in DMSO
InChIKey
KSQNKZMAMGACTL-HNNXBMFYSA-N
Catalogue number
GC43348
Brand
GLPBIO
Computed properties PubChem CID 179574 · XLogP 2.4 · TPSA 49.4 Ų · H-bond donors 1
XLogP
2.4
TPSA
49.4 Ų
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
21

SMILES CN1[C@H](C(=O)NC2=CC=CC=C2C1=O)CC3=CC=CC=C3

Computed descriptors from PubChem (CID 179574), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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