Compound C26H39ClN4O4

2-[4-amino-3-[2-amino-5-[2-(diethylamino)ethoxycarbonyl]phenyl]benzoyl]oxyethyl-diethylazanium chloride

CAS: 63992-37-0

Molecular Formula	`C26H39ClN4O4`
Molecular Weight	507.1 g/mol
Topological Polar Surface Area	112.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	8
Rotatable Bonds	15
Exact Mass	506.266
Heavy Atoms	35
Complexity	612.0

Chemical Identifiers

CAS Number	63992-37-0
SMILES	`CC[NH+](CC)CCOC(=O)C1=CC(=C(C=C1)N)C2=C(C=CC(=C2)C(=O)OCCN(CC)CC)N.[Cl-]`
InChIKey	`FBUQNJJEIGYAFR-UHFFFAOYSA-N`

📖 Product Overview

Compound C26H39ClN4O4 (CAS: 63992-37-0) is a chemical compound with molecular formula C26H39ClN4O4 and molecular weight 507.1 g/mol. Its IUPAC systematic name is 2-[4-amino-3-[2-amino-5-[2-(diethylamino)ethoxycarbonyl]phenyl]benzoyl]oxyethyl-diethylazanium chloride. Topological Polar Surface Area 112.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 8 Rotatable Bonds 15 Exact Mass 506.266 Heavy Atoms 35 Complexity 612.0 InChI Key: FBUQNJJEIGYAFR-UHFFFAOYSA-N. SMILES: CC[NH+](CC)CCOC(=O)C1=CC(=C(C=C1)N)C2=C(C=CC(=C2)C(=O)OCCN(CC)CC)N.[Cl-].

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