N-Butyl-N'-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]1,3,4-thiadiazole-2,5-diamine

HCID 13657367
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Basic information

Standard SMILES
CCCCNc1nnc(NCCCOc2cccc(CN3CCCCC3)c2)s1
InChIKey
ZHHSNCODWGFVIP-UHFFFAOYSA-N
Molecular formula
C21H33N5OS
Average molar mass
403.6 g/mol

Names & identifiers

Preferred name
N-Butyl-N'-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]1,3,4-thiadiazole-2,5-diamine
IUPAC
5-N-butyl-2-N-[3-[3-(piperidin-1-ylmethyl)phenoxy]propyl]-1,3,4-thiadiazole-2,5-diamine

Names & synonyms

SCHEMBL10669319ZHHSNCODWGFVIP-UHFFFAOYSA-NN-Butyl-N'-[3-[3-(1-piperidinylmethyl)phenoxy]propyl]1,3,4-thiadiazole-2,5-diamine

Database identifiers

PubChem CID
13657367

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
90.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
12
Heavy atoms
28

Related reactions

1 records
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Compound notes

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