BRN 0561562

3-(4-fluorophenyl)-2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

CAS: 34387-08-1

Molecular Formula	`C17H15FN2OS`
Molecular Weight	314.4 g/mol
LogP	3.8
Topological Polar Surface Area	60.9 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	1
Exact Mass	314.0889
Heavy Atoms	22
Complexity	489.0

Chemical Identifiers

CAS Number	34387-08-1
SMILES	`CC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4=CC=C(C=C4)F`
InChIKey	`BOVPWLXJWLKDKJ-UHFFFAOYSA-N`

📖 Product Overview

BRN 0561562 (CAS: 34387-08-1) is a chemical compound with molecular formula C17H15FN2OS and molecular weight 314.4 g/mol. Its IUPAC systematic name is 3-(4-fluorophenyl)-2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one. LogP 3.8 Topological Polar Surface Area 60.9 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 1 Exact Mass 314.0889 Heavy Atoms 22 Complexity 489.0 InChI Key: BOVPWLXJWLKDKJ-UHFFFAOYSA-N. SMILES: CC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1C4=CC=C(C=C4)F.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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