Cromoglicate lisetil

Base Information

• Chemical Name: Cromoglicate lisetil
• CAS No.: 110816-79-0
• Molecular Formula: C33H36 N2 O12
• Molecular Weight: 652.65
• UNII: VOZ07VZP8G
• Nikkaji Number: J561.795B
• Wikidata: Q27291940
• NCI Thesaurus Code: C77516
• ChEMBL ID: CHEMBL3560664
• Mol file: 110816-79-0.mol

Synonyms:Cromoglicate lisetil;110816-79-0;Cromoglicate lisetil [INN];UNII-VOZ07VZP8G;VOZ07VZP8G;Cromoglicate lisetil (INN);Diethyl 5,5'-((2-hydroxytrimethylene)dioxy)bis(4-oxo-4H-1-benzopyran-2-carboxylate), ester with L-lysine;DTXSID5057620;ethyl 5-[2-[(2S)-2,6-diaminohexanoyl]oxy-3-(2-ethoxycarbonyl-4-oxo-chromen-5-yl)oxy-propoxy]-4-oxo-chromene-2-carboxylate;Cromoglicate etilisate;D0VZ9S;ethyl 5-[2-[(2S)-2,6-diaminohexanoyl]oxy-3-(2-ethoxycarbonyl-4-oxochromen-5-yl)oxypropoxy]-4-oxochromene-2-carboxylate;SCHEMBL2111864;CHEMBL3560664;DTXCID2031409;CHEBI:31438;Tox21_113952;CROMOGLICATE LISETIL [WHO-DD];CROMOGLYCATE LISETIL HYDROCHLORIDE;NCGC00262961-01;Diethyl L-lysylcromoglycate dihydrochloride;CAS-110816-79-0;D02589;Cromoglycate lisetil hydrochloride < Prop INNM >;Q27291940;Diethyl 5,5'-((2-hydroxytrimethylene)dioxy)bis(4-oxo-4H-1-benzopyran-2-carboxylate), ester with L-lysine.;ethyl 5-[2-[(2S)-2,6-diaminohexanoyl]oxy-3-(2-ethoxycarbonyl-4-oxo-chromen-5-yl)oxy-propoxy]-4-oxo-c

Chemical Property of Cromoglicate lisetil

Chemical Property:

• Vapor Pressure: 6.46E-25mmHg at 25°C
• Boiling Point: 789.7°Cat760mmHg
• Flash Point: 212.5°C
• PSA: 209.82000
• Density: 1.345g/cm³
• LogP: 4.47930
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 14
• Rotatable Bond Count: 19
• Exact Mass: 652.22682459
• Heavy Atom Count: 47
• Complexity: 1130

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=CC(=O)C2=C(O1)C=CC=C2OCC(COC3=CC=CC4=C3C(=O)C=C(O4)C(=O)OCC)OC(=O)C(CCCCN)N
• Isomeric SMILES: CCOC(=O)C1=CC(=O)C2=C(O1)C=CC=C2OCC(COC3=CC=CC4=C3C(=O)C=C(O4)C(=O)OCC)OC(=O)[C@H](CCCCN)N
• Uses: Cromoglicate Lisetil is used in identification of non-nucleoside human ribonucleotide reductase modulators and their antitumor activity.