Compound C22H21N3O6

4-[[2-(5-ethyl-3-methyl-2,4,6-trioxo-5-phenyl-1,3-diazinan-1-yl)acetyl]amino]benzoic acid

CAS: 70959-38-5

Molecular Formula	`C22H21N3O6`
Molecular Weight	423.4 g/mol
LogP	2.0
Topological Polar Surface Area	124.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	423.14304
Heavy Atoms	31
Complexity	754.0

Chemical Identifiers

CAS Number	70959-38-5
SMILES	`CCC1(C(=O)N(C(=O)N(C1=O)CC(=O)NC2=CC=C(C=C2)C(=O)O)C)C3=CC=CC=C3`
InChIKey	`ZLULGRNPNAODMB-UHFFFAOYSA-N`

📖 Product Overview

Compound C22H21N3O6 (CAS: 70959-38-5) is a chemical compound with molecular formula C22H21N3O6 and molecular weight 423.4 g/mol. Its IUPAC systematic name is 4-[[2-(5-ethyl-3-methyl-2,4,6-trioxo-5-phenyl-1,3-diazinan-1-yl)acetyl]amino]benzoic acid. LogP 2.0 Topological Polar Surface Area 124.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 6 Rotatable Bonds 6 Exact Mass 423.14304 Heavy Atoms 31 Complexity 754.0 InChI Key: ZLULGRNPNAODMB-UHFFFAOYSA-N. SMILES: CCC1(C(=O)N(C(=O)N(C1=O)CC(=O)NC2=CC=C(C=C2)C(=O)O)C)C3=CC=CC=C3.

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