N'-{2-Chloro-5-[5-(3-chlorothiophen-2-yl)-[1,2,4]oxadiazol-3-yl]-phenyl}-N,N-diethyl-ethane-1,2-diamine

HCID 16222811
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Basic information

Standard SMILES
CCN(CC)CCNc1cc(-c2noc(-c3sccc3Cl)n2)ccc1Cl
InChIKey
QOSITMBLTRHMEM-UHFFFAOYSA-N
Molecular formula
C18H20Cl2N4OS
Average molar mass
411.3 g/mol

Names & identifiers

Preferred name
N'-{2-Chloro-5-[5-(3-chlorothiophen-2-yl)-[1,2,4]oxadiazol-3-yl]-phenyl}-N,N-diethyl-ethane-1,2-diamine
IUPAC
N-[2-chloro-5-[5-(3-chlorothiophen-2-yl)-1,2,4-oxadiazol-3-yl]phenyl]-N',N'-diethylethane-1,2-diamine

Names & synonyms

SCHEMBL4586300QOSITMBLTRHMEM-UHFFFAOYSA-NN'-{2-Chloro-5-[5-(3-chlorothiophen-2-yl)-[1,2,4]oxadiazol-3-yl]-phenyl}-N,N-diethyl-ethane-1,2-diamine

Database identifiers

PubChem CID
16222811

Properties

Computed structural properties

XLogP
5.2
Topological polar surface area
82.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
8
Heavy atoms
26

Related reactions

1 records
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Compound notes

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