AC1LDBUQ structure

AC1LDBUQ

ethyl 2-[1-(4-chlorophenyl)pyrazolo[5,4-d]pyrimidin-4-yl]sulfanylacetate

Also Known As: ASN 05100483|SR-01000340770-1|F1874-0711|ethyl 2-[1-(4-chlorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]sulfanylacetate|[1-(4-Chloro-phenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-ylsulfanyl]-acetic acid ethyl ester|ethyl 2-{[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}acetate|ethyl 2-((1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl)thio)acetate

CAS: 577756-70-8
Molecular Formula C15H13ClN4O2S
Molecular Weight 348.04477 g/mol
LogP 3.6
Topological Polar Surface Area 95.2 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 6
Rotatable Bonds 6
Exact Mass 348.04477
Monoisotopic Mass 348.04477
Heavy Atoms 23
Complexity 409.0

Chemical Identifiers

CAS Number 577756-70-8
SMILES CCOC(=O)CSC1=NC=NC2=C1C=NN2C3=CC=C(C=C3)Cl
InChIKey QFIYZMTXSYRNNX-UHFFFAOYSA-N

Product Overview

AC1LDBUQ (CAS 577756-70-8), with molecular formula C15H13ClN4O2S and molecular weight 348.04477 g/mol. IUPAC: ethyl 2-[1-(4-chlorophenyl)pyrazolo[5,4-d]pyrimidin-4-yl]sulfanylacetate.

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