AC1NKPPV structure

AC1NKPPV

4-(7,14-dimethyl-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-4-yl)-N,N-dimethylaniline

Also Known As: 4-(5,10-dimethyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-N,N-dimethylaniline|4-(5,10-dimethyl-8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-2-yl)-N,N-dimethylaniline

CAS: 899397-86-5
Molecular Formula C21H23N5S
Molecular Weight 377.16742 g/mol
LogP 4.50522
Topological Polar Surface Area 46.32 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 5
Rotatable Bonds 2
Exact Mass 377.16742
Monoisotopic Mass 377.16742
Heavy Atoms 27
Complexity 1153.2101

Chemical Identifiers

CAS Number 899397-86-5
SMILES CC1CCC2=C(C1)C3=C(S2)N=C(N4C3=NC(=N4)C5=CC=C(C=C5)N(C)C)C

Product Overview

AC1NKPPV (CAS 899397-86-5), with molecular formula C21H23N5S and molecular weight 377.16742 g/mol. IUPAC: 4-(7,14-dimethyl-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-4-yl)-N,N-dimethylaniline.

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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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