Name: Name:8-Chloro-[1,3]dioxolo[4,5-g]quinazoline
Brand: Angene
SKU: AG005Q4T
Rating: 90 (10 reviews)

8-Chloro-[1,3]dioxolo[4,5-g]quinazoline

CAS No.:

72700-23-3

Catalog Number:

AG005Q4T

Molecular Formula:

C9H5ClN2O2

Molecular Weight:

208.6012

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Purity

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Product Description

Catalog Number:

AG005Q4T

Chemical Name:

8-Chloro-[1,3]dioxolo[4,5-g]quinazoline

CAS Number:

72700-23-3

Molecular Formula:

C9H5ClN2O2

Molecular Weight:

208.6012

MDL Number:

MFCD09835373

IUPAC Name:

8-chloro-[1,3]dioxolo[4,5-g]quinazoline

InChI:

InChI=1S/C9H5ClN2O2/c10-9-5-1-7-8(14-4-13-7)2-6(5)11-3-12-9/h1-3H,4H2

InChI Key:

RZCJSVRGPHXBSM-UHFFFAOYSA-N

SMILES:

Clc1ncnc2c1cc1OCOc1c2

Properties

Complexity:

229

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

208.004g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

208.601g/mol

Monoisotopic Mass:

208.004g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

44.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.3

Literature

Title	Journal
Design, synthesis, and DNA-binding of N-alkyl(anilino)quinazoline derivatives.	Journal of medicinal chemistry 20101125