L3M2ND6ZYF structure

L3M2ND6ZYF

2-chloro-5-[[2-[(2-methylphenyl)methyl]-8-oxo-2,4,7,11-tetrazatricyclo[7.4.0.03,7]trideca-1(9),3-dien-11-yl]sulfonyl]benzenesulfonamide

Also Known As: 2-Chloro-5-((9-((2-methylphenyl)methyl)-4-oxo(5,6,7,8,9,3a-hexahydro-2-imidazolino(1,2-a)pyridino(4,3-d)pyrimidin-6-yl))sulfonyl)benzenesulfonamide|2-chloro-5-({2-[(2-methylphenyl)methyl]-8-oxo-2,4,7,11-tetraazatricyclo[7.4.0.0{3,7}]trideca-1(9),3-dien-11-yl}sulfonyl)benzene-1-sulfonamide|2-Chloro-5-({9-[(2-methylphenyl)methyl]-4-oxo(5,6,7,8,9,3a-hexahydro-2-imidazolino[1,2-a]pyridino[4,3-d]pyrimidin-6-yl)}sulfonyl)benzenesulfonamide|2-chloro-5-[[10-(o-tolylmethyl)-5-oxo-3,6,8,9-tetrahydro-2H-imidazo[[?]]pyrido[[?]]pyrimidin-7-yl]sulfonyl]benzenesulfonamide|2-Chloro-5-[[2,3,6,8,9,10-hexahydro-10-[(2-methylphenyl)methyl]-5-oxoimidazo[1,2-a]pyrido[4,3-d]pyrimidin-7(5H)-yl]sulfonyl]benzenesulfonamide|2-Chloro-5-[9-(2-methyl-benzyl)-4-oxo-2,3,5,7,8,9-hexahydro-4H-1,3a,6,9-tetraaza-cyclopenta[b]naphthalene-6-sulfonyl]-benzenesulfonamide|2-Chloro-5-{10-[(2-methylphenyl)methyl]-5-oxo-2,3,6,8,9,10-hexahydroimidazo[1,2-a]pyrido[4,3-d]pyrimidine-7(5H)-sulfonyl}benzene-1-sulfonamide|Benzenesulfonamide, 2-chloro-5-[[2,3,6,8,9, 10-hexahydro-10-[(2-methylphenyl)methyl]-5-oxoimidazo[1, 2-a]pyrido[4,3-d]pyrimidin 7(5H)-yl]sulfonyl]-|Benzenesulfonamide, 2-chloro-5-[[2,3,6,8,9,10-hexahydro-10-[(2-methylphenyl)methyl]-5-oxoimidazo[1,2-a]pyrido[4,3-d]pyrimidin-7(5H)-yl]sulfonyl]-|Benzenesulfonamide,3,6,8,9,10-hexahydro-10-[(2-methylphenyl)methyl]-5-oxoimidazo[1,2-a]pyrido[4,3-d]pyrimidin-7(5H)-yl]sulfonyl]-

CAS: 41276-23-7
Molecular Formula C23H24ClN5O5S2
Molecular Weight 549.09076 g/mol
LogP 0.8
Topological Polar Surface Area 150.0 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 8
Rotatable Bonds 5
Exact Mass 549.09076
Monoisotopic Mass 549.09076
Heavy Atoms 36
Complexity 1180.0

Chemical Identifiers

CAS Number 41276-23-7
SMILES CC1=CC=CC=C1CN2C3=C(CN(CC3)S(=O)(=O)C4=CC(=C(C=C4)Cl)S(=O)(=O)N)C(=O)N5C2=NCC5
InChIKey VDMIXURZCFZVBO-UHFFFAOYSA-N

Product Overview

L3M2ND6ZYF (CAS 41276-23-7), with molecular formula C23H24ClN5O5S2 and molecular weight 549.09076 g/mol. IUPAC: 2-chloro-5-[[2-[(2-methylphenyl)methyl]-8-oxo-2,4,7,11-tetrazatricyclo[7.4.0.03,7]trideca-1(9),3-dien-11-yl]sulfonyl]benzenesulfonamide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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