3-[3-(4-methylimidazol-1-yl)propyl]-2-sulfanylidene-1H-quinazolin-4-one

HCID 25100202
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Basic information

Standard SMILES
Cc1cn(CCCn2c(=S)[nH]c3ccccc3c2=O)cn1
InChIKey
KVMHBFZMWNXGQU-UHFFFAOYSA-N
Molecular formula
C15H16N4OS
Average molar mass
300.4 g/mol

Names & identifiers

Preferred name
3-[3-(4-methylimidazol-1-yl)propyl]-2-sulfanylidene-1H-quinazolin-4-one
IUPAC
3-[3-(4-methylimidazol-1-yl)propyl]-2-sulfanylidene-1H-quinazolin-4-one

Names & synonyms

SCHEMBL3639892CHEMBL3703763KVMHBFZMWNXGQU-UHFFFAOYSA-N

Database identifiers

PubChem CID
25100202
ChEMBL
CHEMBL3703763

Properties

Computed structural properties

XLogP
1.7
Topological polar surface area
82.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
21

Related reactions

1 records
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Compound notes

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