Compound C19H22ClN5O5

7-chloro-8-methoxy-10-(2-pyrrolidin-1-ium-1-ylethyl)benzo[g]pteridine-2,4-dione acetate

CAS: 99999-42-5

Molecular Formula	`C19H22ClN5O5`
Molecular Weight	435.9 g/mol
Topological Polar Surface Area	128.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	4
Exact Mass	435.13095
Heavy Atoms	30
Complexity	686.0

Chemical Identifiers

CAS Number	99999-42-5
SMILES	`CC(=O)[O-].COC1=C(C=C2C(=C1)N(C3=NC(=O)NC(=O)C3=N2)CC[NH+]4CCCC4)Cl`
InChIKey	`KAYSNYLXLZGXMV-UHFFFAOYSA-N`

📖 Product Overview

Compound C19H22ClN5O5 (CAS: 99999-42-5) is a chemical compound with molecular formula C19H22ClN5O5 and molecular weight 435.9 g/mol. Its IUPAC systematic name is 7-chloro-8-methoxy-10-(2-pyrrolidin-1-ium-1-ylethyl)benzo[g]pteridine-2,4-dione acetate. Topological Polar Surface Area 128.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 6 Rotatable Bonds 4 Exact Mass 435.13095 Heavy Atoms 30 Complexity 686.0 InChI Key: KAYSNYLXLZGXMV-UHFFFAOYSA-N. SMILES: CC(=O)[O-].COC1=C(C=C2C(=C1)N(C3=NC(=O)NC(=O)C3=N2)CC[NH+]4CCCC4)Cl.

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