AC1LR4Z6 structure

AC1LR4Z6

2-[[12,12-dimethyl-4-(3-methylphenyl)-3-oxo-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]-N-phenylacetamide

Also Known As: 2-((6,6-dimethyl-4-oxo-3-(m-tolyl)-4,5,6,8-tetrahydro-3H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)thio)-N-phenylacetamide|2-{[6,6-dimethyl-3-(3-methylphenyl)-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}-N-phenylacetamide

CAS: 489397-67-3
Molecular Formula C26H25N3O3S2
Molecular Weight 491.13373 g/mol
LogP 5.33772
Topological Polar Surface Area 73.22 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 5
Exact Mass 491.13373
Monoisotopic Mass 491.13373
Heavy Atoms 34
Complexity 1441.2008

Chemical Identifiers

CAS Number 489397-67-3
SMILES CC1=CC(=CC=C1)N2C(=O)C3=C(N=C2SCC(=O)NC4=CC=CC=C4)SC5=C3CC(OC5)(C)C

Product Overview

AC1LR4Z6 (CAS 489397-67-3), with molecular formula C26H25N3O3S2 and molecular weight 491.13373 g/mol. IUPAC: 2-[[12,12-dimethyl-4-(3-methylphenyl)-3-oxo-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-5-yl]sulfanyl]-N-phenylacetamide.

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