[4-(Benzo[b]thiophen-2-yl)-pyrimidin-2-yl]-[3-(4-methylpiperazin-1-yl)-propyl]-amine

HCID 57720607
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Basic information

Standard SMILES
CN1CCN(CCCNc2nccc(-c3cc4ccccc4s3)n2)CC1
InChIKey
STNOBDOQYMUVEB-UHFFFAOYSA-N
Molecular formula
C20H25N5S
Average molar mass
367.5 g/mol

Names & identifiers

Preferred name
[4-(Benzo[b]thiophen-2-yl)-pyrimidin-2-yl]-[3-(4-methylpiperazin-1-yl)-propyl]-amine
IUPAC
4-(1-benzothiophen-2-yl)-N-[3-(4-methylpiperazin-1-yl)propyl]pyrimidin-2-amine

Names & synonyms

SCHEMBL3969427STNOBDOQYMUVEB-UHFFFAOYSA-N[4-(benzo[b]thiophen-2-yl)-pyrimidin-2-yl]-[3-(4-methylpiperazin-1-yl)-propyl]-amine

Database identifiers

PubChem CID
57720607

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
72.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
26

Related reactions

4 records
New reaction record

Compound notes

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