Compound C21H12N2O2S2

1-amino-4-(1,3-benzothiazol-2-ylsulfanyl)anthracene-9,10-dione

CAS: 3767-68-8

Molecular Formula	`C21H12N2O2S2`
Molecular Weight	388.5 g/mol
LogP	5.6
Topological Polar Surface Area	127.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	2
Exact Mass	388.03403
Heavy Atoms	27
Complexity	615.0

Chemical Identifiers

CAS Number	3767-68-8
SMILES	`C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)SC4=NC5=CC=CC=C5S4)N`
InChIKey	`LZBSRGGBVAHAED-UHFFFAOYSA-N`

📖 Product Overview

Compound C21H12N2O2S2 (CAS: 3767-68-8) is a chemical compound with molecular formula C21H12N2O2S2 and molecular weight 388.5 g/mol. Its IUPAC systematic name is 1-amino-4-(1,3-benzothiazol-2-ylsulfanyl)anthracene-9,10-dione. LogP 5.6 Topological Polar Surface Area 127.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 6 Rotatable Bonds 2 Exact Mass 388.03403 Heavy Atoms 27 Complexity 615.0 InChI Key: LZBSRGGBVAHAED-UHFFFAOYSA-N. SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)SC4=NC5=CC=CC=C5S4)N.

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