2,3,8,9-Tetrahydro-5-(4-methoxyphenyl)-9-[(4-methoxyphenyl)methylene]-5H,6H-thiazolo[3,2-a]thiopyrano[4,3-d]pyrimidine

HCID 21786673
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Basic information

Standard SMILES
COc1ccc(C=C2CSCC3=C2N=C2SCCN2C3c2ccc(OC)cc2)cc1
InChIKey
HPHSFLAAGXLLDA-UHFFFAOYSA-N
Molecular formula
C24H24N2O2S2
Average molar mass
436.6 g/mol

Names & identifiers

Preferred name
2,3,8,9-Tetrahydro-5-(4-methoxyphenyl)-9-[(4-methoxyphenyl)methylene]-5H,6H-thiazolo[3,2-a]thiopyrano[4,3-d]pyrimidine
IUPAC
8-(4-methoxyphenyl)-13-[(4-methoxyphenyl)methylidene]-4,11-dithia-2,7-diazatricyclo[7.4.0.03,7]trideca-1(9),2-diene

Names & synonyms

SCHEMBL11607445HPHSFLAAGXLLDA-UHFFFAOYSA-N2,3,8,9-Tetrahydro-5-(4-methoxyphenyl)-9-[(4-methoxyphenyl)methylene]-5H,6H-thiazolo[3,2-a]thiopyrano[4,3-d]pyrimidine

Database identifiers

PubChem CID
21786673

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
84.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
30

Related reactions

1 records
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Compound notes

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