AC1N0TWP structure

AC1N0TWP

4-(4-methylsulfanyl-11-thia-3,5,6,8,13-pentazapentacyclo[10.8.0.02,10.05,9.015,20]icosa-1(12),2(10),3,6,8,13,15(20)-heptaen-14-yl)morpholine

Also Known As: 4-(5-(methylthio)-7,8,9,10-tetrahydro-[1,2,4]triazolo[1'',5'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinolin-11-yl)morpholine|5-(methylsulfanyl)-11-(morpholin-4-yl)-7,8,9,10-tetrahydro[1,2,4]triazolo[1'',5'':1',6']pyrimido[4',5':4,5]thieno[2,3-c]isoquinoline

CAS: 328069-47-2
Molecular Formula C19H20N6OS2
Molecular Weight 412.114 g/mol
LogP 3.3245
Topological Polar Surface Area 68.44 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 8
Rotatable Bonds 2
Exact Mass 412.114
Monoisotopic Mass 412.114
Heavy Atoms 28
Complexity 1210.0188

Chemical Identifiers

CAS Number 328069-47-2
SMILES CSC1=NC2=C(C3=NC=NN31)SC4=C2C5=C(CCCC5)C(=N4)N6CCOCC6

Product Overview

AC1N0TWP (CAS 328069-47-2), with molecular formula C19H20N6OS2 and molecular weight 412.114 g/mol. IUPAC: 4-(4-methylsulfanyl-11-thia-3,5,6,8,13-pentazapentacyclo[10.8.0.02,10.05,9.015,20]icosa-1(12),2(10),3,6,8,13,15(20)-heptaen-14-yl)morpholine.

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