Icotinib Hydrochloride
N-(3-ethynylphenyl)-2,5,8,11-tetraoxa-15,17-diazatricyclo[10.8.0.014,19]icosa-1(12),13,15,17,19-pentaen-18-amine;hydrochloride
Molecular Identity
Icotinib Hydrochloride
N-(3-ethynylphenyl)-2,5,8,11-tetraoxa-15,17-diazatricyclo[10.8.0.014,19]icosa-1(12),13,15,17,19-pentaen-18-amine;hydrochloride
PubChem CID: 44609731
Icotinib hydrochloride is a member of quinazolines.
2D Structure
Properties
C22H22ClN3O4
Molecular Formula
427.90
Molecular Weight
g/mol
427.1299
Exact Mass
Da
74.7
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
7
H-Bond Acceptors
553
Complexity
SMILES
Canonical SMILES
SMILES: C#CC1=CC(=CC=C1)NC2=NC=NC3=CC4=C(C=C32)OCCOCCOCCO4.ClIsomeric SMILES
SMILES: C#CC1=CC(=CC=C1)NC2=NC=NC3=CC4=C(C=C32)OCCOCCOCCO4.ClSynonyms(20)
Icotinib Hydrochloride1204313-51-8Icotinib HClBPI-2009HUNII-JTD32I0J83JTD32I0J83DTXSID80152859ICOTINIB HYDROCHLORIDE [WHO-DD](1,4,7,10)Tetraoxacyclododecino(2,3-g)quinazolin-4-amine, N-(3-ethynylphenyl)-7,8,10,11,13,14-hexahydro-, hydrochloride (1:1)RefChem:147675DTXCID6075350ConmanaIcotinib (Hydrochloride)N-(3-ethynylphenyl)-2,5,8,11-tetraoxa-15,17-diazatricyclo[10.8.0.014,19]icosa-1(12),13,15,17,19-pentaen-18-amine;hydrochlorideC22H22ClN3O4
Data from PubChem (NCBI)
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