cbl0137
1-[6-acetyl-9-[2-(propan-2-ylamino)ethyl]carbazol-3-yl]ethanone
Molecular Identity
cbl0137
1-[6-acetyl-9-[2-(propan-2-ylamino)ethyl]carbazol-3-yl]ethanone
PubChem CID: 44519124
CBL0137 is a member of the class of carbazoles that is 9H-carbazole which is substituted by acetyl groups at positions 3 and 6, and by a 2-isopropylethyl group on the nitrogen atom (position 9). It is a modulator of histone chaperone FACT (FAcilitates Chromatin Transcription) - interaction of CBL0137 with the FACT complex results in simultaneous NF- beta suppression, Heat Shock Transcription Factor 1 (HSF1) suppression and p53 activation - and shows antitumour effects in animal models of various cancers. It has a role as an antineoplastic agent, an apoptosis inducer, a NF-kappaB inhibitor and a p53 activator. It is a member of carbazoles, a secondary amino compound, a tertiary amino compound, a methyl ketone and an aromatic ketone.
2D Structure
Properties
C21H24N2O2
Molecular Formula
336.40
Molecular Weight
g/mol
336.1838
Exact Mass
Da
3
XLogP
Drug-like (Lipinski: < 5)
51.1
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
3
H-Bond Acceptors
466
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
cbl01371197996-80-7CBL-0137 free base8XKR07H9ERCHEBI:138650DTXSID10152589RefChem:906544DTXCID90750801,1'-(9-(2-((1-Methylethyl)amino)ethyl)-9H-carbazole-3,6-diyl)bis(ethanone)CBL-0137CBL 0137Ethanone, 1,1'-[9-[2-[(1-methylethyl)amino]ethyl]-9H-carbazole-3,6-diyl]bis-1,1'-(9-(2-(isopropylamino)ethyl)-9H-carbazole-3,6-diyl)bis(ethan-1-one)CBL 137; Curaxin 137CHEMBL4640631
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to cbl0137
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