AC1LXJFP structure

AC1LXJFP

2-[[7-(2-methylpropyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl]sulfanyl]-N-naphthalen-1-ylacetamide

Also Known As: Oprea1_503097|2-((4-isobutyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)thio)-N-(naphthalen-1-yl)acetamide|2-{[4-(2-methylpropyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide

CAS: 799792-40-8
Molecular Formula C28H26N4OS2
Molecular Weight 498.15482 g/mol
LogP 6.8107
Topological Polar Surface Area 67.77 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 6
Rotatable Bonds 6
Exact Mass 498.15482
Monoisotopic Mass 498.15482
Heavy Atoms 35
Complexity 1585.8667

Chemical Identifiers

CAS Number 799792-40-8
SMILES CC(C)CC1=NC2=C(C3=C1CCC3)C4=C(S2)C(=NC=N4)SCC(=O)NC5=CC=CC6=CC=CC=C65

Product Overview

AC1LXJFP (CAS 799792-40-8), with molecular formula C28H26N4OS2 and molecular weight 498.15482 g/mol. IUPAC: 2-[[7-(2-methylpropyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl]sulfanyl]-N-naphthalen-1-ylacetamide.

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