Verosudil
2-(dimethylamino)-N-(1-oxo-2H-isoquinolin-6-yl)-2-thiophen-3-ylacetamide
Molecular Identity
Verosudil
2-(dimethylamino)-N-(1-oxo-2H-isoquinolin-6-yl)-2-thiophen-3-ylacetamide
PubChem CID: 66906051
2D Structure
Properties
C17H17N3O2S
Molecular Formula
327.40
Molecular Weight
g/mol
327.1041
Exact Mass
Da
2
XLogP
Drug-like (Lipinski: < 5)
89.7
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
4
H-Bond Acceptors
494
Complexity
SMILES
Canonical SMILES
SMILES: CN(C)C(C1=CSC=C1)C(=O)NC2=CC3=C(C=C2)C(=O)NC=C3Isomeric SMILES
SMILES: CN(C)C(C1=CSC=C1)C(=O)NC2=CC3=C(C=C2)C(=O)NC=C3Synonyms(20)
Verosudil1414854-42-4AR-12286MAF34143WMAR-12286 FREE BASEAR 122862-(dimethylamino)-N-(1-oxo-2H-isoquinolin-6-yl)-2-thiophen-3-ylacetamideDTXSID801336680verosudilumRefChem:933989DTXCID301766915Verosudil(AR-12286)2-(Dimethylamino)-N-(1-oxo-1,2-dihydroisoquinolin-6-yl)-2-(thiophen-3-yl)acetamideVerosudil [USAN:INN]UNII-MAF34143WM
Data from PubChem (NCBI)
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