ethyl 4-[[2,4-diamino-6-(diethylamino)pyrimidin-5-yl]diazenyl]benzoate

CAS: 4369-91-9

Molecular Formula	`C17H23N7O2`
Molecular Weight	357.4 g/mol
LogP	2.7
Topological Polar Surface Area	132.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	9
Rotatable Bonds	8
Exact Mass	357.1913
Heavy Atoms	26
Complexity	464.0

Chemical Identifiers

CAS Number	4369-91-9
SMILES	`CCN(CC)C1=NC(=NC(=C1N=NC2=CC=C(C=C2)C(=O)OCC)N)N`
InChIKey	`TYKDUZBCZNUTDM-UHFFFAOYSA-N`

📖 Product Overview

ethyl 4-[[2,4-diamino-6-(diethylamino)pyrimidin-5-yl]diazenyl]benzoate (CAS: 4369-91-9) is a chemical compound with molecular formula C17H23N7O2 and molecular weight 357.4 g/mol. Its IUPAC systematic name is ethyl 4-[[2,4-diamino-6-(diethylamino)pyrimidin-5-yl]diazenyl]benzoate. LogP 2.7 Topological Polar Surface Area 132.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 9 Rotatable Bonds 8 Exact Mass 357.1913 Heavy Atoms 26 Complexity 464.0 InChI Key: TYKDUZBCZNUTDM-UHFFFAOYSA-N. SMILES: CCN(CC)C1=NC(=NC(=C1N=NC2=CC=C(C=C2)C(=O)OCC)N)N.

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