Compound C22H26N2O2S

4-(hydroxymethyl)-1-[2-(2-methylpiperidin-1-yl)ethylamino]thioxanthen-9-one

CAS: 16140-28-6

Molecular Formula	`C22H26N2O2S`
Molecular Weight	382.5 g/mol
LogP	3.2
Topological Polar Surface Area	77.9 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	5
Exact Mass	382.1715
Heavy Atoms	27
Complexity	517.0

Chemical Identifiers

CAS Number	16140-28-6
SMILES	`CC1CCCCN1CCNC2=C3C(=C(C=C2)CO)SC4=CC=CC=C4C3=O`
InChIKey	`PVZAIFPRJDURMZ-UHFFFAOYSA-N`

📖 Product Overview

Compound C22H26N2O2S (CAS: 16140-28-6) is a chemical compound with molecular formula C22H26N2O2S and molecular weight 382.5 g/mol. Its IUPAC systematic name is 4-(hydroxymethyl)-1-[2-(2-methylpiperidin-1-yl)ethylamino]thioxanthen-9-one. LogP 3.2 Topological Polar Surface Area 77.9 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 5 Exact Mass 382.1715 Heavy Atoms 27 Complexity 517.0 InChI Key: PVZAIFPRJDURMZ-UHFFFAOYSA-N. SMILES: CC1CCCCN1CCNC2=C3C(=C(C=C2)CO)SC4=CC=CC=C4C3=O.

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