Compound C22H16N2O6

[4-(4,8-diamino-1,5-dihydroxy-9,10-dioxoanthracen-2-yl)phenyl] acetate

CAS: 3753-50-2

Molecular Formula	`C22H16N2O6`
Molecular Weight	404.4 g/mol
LogP	3.3
Topological Polar Surface Area	153.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	8
Rotatable Bonds	3
Exact Mass	404.10083
Heavy Atoms	30
Complexity	706.0

Chemical Identifiers

CAS Number	3753-50-2
SMILES	`CC(=O)OC1=CC=C(C=C1)C2=CC(=C3C(=C2O)C(=O)C4=C(C=CC(=C4C3=O)O)N)N`
InChIKey	`ODMIJAPLDKMEPD-UHFFFAOYSA-N`

📖 Product Overview

Compound C22H16N2O6 (CAS: 3753-50-2) is a chemical compound with molecular formula C22H16N2O6 and molecular weight 404.4 g/mol. Its IUPAC systematic name is [4-(4,8-diamino-1,5-dihydroxy-9,10-dioxoanthracen-2-yl)phenyl] acetate. LogP 3.3 Topological Polar Surface Area 153.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 8 Rotatable Bonds 3 Exact Mass 404.10083 Heavy Atoms 30 Complexity 706.0 InChI Key: ODMIJAPLDKMEPD-UHFFFAOYSA-N. SMILES: CC(=O)OC1=CC=C(C=C1)C2=CC(=C3C(=C2O)C(=O)C4=C(C=CC(=C4C3=O)O)N)N.

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