Compound C22H26F3N3O4S

2-methoxy-5-methylsulfonyl-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]benzamide

CAS: 82608-06-8

Molecular Formula	`C22H26F3N3O4S`
Molecular Weight	485.5 g/mol
LogP	2.6
Topological Polar Surface Area	87.3 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	9
Rotatable Bonds	7
Exact Mass	485.1596
Heavy Atoms	33
Complexity	751.0

Chemical Identifiers

CAS Number	82608-06-8
SMILES	`COC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)NCCN2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F`
InChIKey	`HAJTXSJCRLTGNH-UHFFFAOYSA-N`

📖 Product Overview

Compound C22H26F3N3O4S (CAS: 82608-06-8) is a chemical compound with molecular formula C22H26F3N3O4S and molecular weight 485.5 g/mol. Its IUPAC systematic name is 2-methoxy-5-methylsulfonyl-N-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]benzamide. LogP 2.6 Topological Polar Surface Area 87.3 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 9 Rotatable Bonds 7 Exact Mass 485.1596 Heavy Atoms 33 Complexity 751.0 InChI Key: HAJTXSJCRLTGNH-UHFFFAOYSA-N. SMILES: COC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)NCCN2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F.

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