Compound C21H28N2O2S

3-(5,5-dioxo-11,12-dihydrobenzo[b][1,6]benzothiazocin-10-yl)-N,N-diethylpropan-1-amine

CAS: 73927-77-2

Molecular Formula	`C21H28N2O2S`
Molecular Weight	372.5 g/mol
LogP	4.0
Topological Polar Surface Area	49.0 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	4
Rotatable Bonds	6
Exact Mass	372.18716
Heavy Atoms	26
Complexity	527.0

Chemical Identifiers

CAS Number	73927-77-2
SMILES	`CCN(CC)CCCN1CCC2=CC=CC=C2S(=O)(=O)C3=CC=CC=C31`
InChIKey	`KXLPAYHMHHRMKJ-UHFFFAOYSA-N`

📖 Product Overview

Compound C21H28N2O2S (CAS: 73927-77-2) is a chemical compound with molecular formula C21H28N2O2S and molecular weight 372.5 g/mol. Its IUPAC systematic name is 3-(5,5-dioxo-11,12-dihydrobenzo[b][1,6]benzothiazocin-10-yl)-N,N-diethylpropan-1-amine. LogP 4.0 Topological Polar Surface Area 49.0 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 4 Rotatable Bonds 6 Exact Mass 372.18716 Heavy Atoms 26 Complexity 527.0 InChI Key: KXLPAYHMHHRMKJ-UHFFFAOYSA-N. SMILES: CCN(CC)CCCN1CCC2=CC=CC=C2S(=O)(=O)C3=CC=CC=C31.

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