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(1-Amino-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl)(2,4-dichlorophenyl)methanone

HCID 178894841
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Basic information

CAS
315247-36-0
Standard SMILES
CCc1nc2sc(C(=O)c3ccc(Cl)cc3Cl)c(N)c2c2c1CCCC2
InChIKey
IPZYNHSDTRDJEJ-UHFFFAOYSA-N
Molecular formula
C20H18Cl2N2OS
Average molar mass
405.3 g/mol

Names & identifiers

Preferred name
(1-Amino-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl)(2,4-dichlorophenyl)methanone
IUPAC
(1-amino-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl)-(2,4-dichlorophenyl)methanone
English name
(1-amino-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl)(2,4-dichlorophenyl)methanone
Molecular formula
C20H18Cl2N2OS
Molecular weight
405.34

Names & synonyms

(1-amino-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl)(2,4-dichlorophenyl)methanone315247-36-0Oprea1_641954STK078979AKOS002176506(1-amino-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl)-(2,4-dichlorophenyl)methanoneST50061998AF-399/149440861-amino-5-ethyl(6,7,8,9-tetrahydrothiopheno[2,3-c]isoquinolin-2-yl) 2,4-dichlo rophenyl ketoneMethanone, (1-amino-5-ethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-2-yl)(2,4-dichlorophenyl)-

Database identifiers

CAS
315247-36-0

Properties

Computed structural properties

XLogP
7.2
Topological polar surface area
84.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
26
Formal charge
0
Complexity
536

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