[4-Amino-2-[4-(2-ethylamino-ethoxy)-phenylamino]-thiazol-5-yl]-(2,3-dihydro-benzofuran-5-yl)-methanone

HCID 10071007
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Basic information

Standard SMILES
CCNCCOc1ccc(Nc2nc(N)c(C(=O)c3ccc4c(c3)CCO4)s2)cc1
InChIKey
GLJAZVDIWLYFBM-UHFFFAOYSA-N
Molecular formula
C22H24N4O3S
Average molar mass
424.5 g/mol
Monoisotopic mass
424.15691181

Names & identifiers

Preferred name
[4-Amino-2-[4-(2-ethylamino-ethoxy)-phenylamino]-thiazol-5-yl]-(2,3-dihydro-benzofuran-5-yl)-methanone
IUPAC
[4-amino-2-[4-[2-(ethylamino)ethoxy]anilino]-1,3-thiazol-5-yl]-(2,3-dihydro-1-benzofuran-5-yl)methanone

Names & synonyms

SCHEMBL6181424GLJAZVDIWLYFBM-UHFFFAOYSA-N[4-Amino-2-[4-(2-ethylamino-ethoxy)-phenylamino]-thiazol-5-yl]-(2,3-dihydro-benzofuran-5-yl)-methanone

Database identifiers

PubChem CID
10071007

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
127 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
8
Rotatable bonds
9
Heavy atoms
30

Related reactions

1 records
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Compound notes

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