AC1MSSCE structure

AC1MSSCE

12-chloro-10-(piperidin-1-ylmethyl)-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraene

Also Known As: 12-Chloro-10-(piperidin-1-ylmethyl)-7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraene|AB00617769-02|SR-01000048041-1|4-chloro-2-(piperidin-1-ylmethyl)-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine|12-chloro-10-[(piperidin-1-yl)methyl]-7-thia-9,11-diazatricyclo[6.4.0.0,2,6]dodeca-1(12),2(6),8,10-tetraene|12-chloro-10-(piperidin-1-ylmethyl)-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraene|4-Chloro-6,7-dihydro-2-(1-piperidinylmethyl)-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidine|12-chloro-10-(1-piperidylmethyl)-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraene|12-chloro-10-[(piperidin-1-yl)methyl]-7-thia-9,11-diazatricyclo[6.4.0.02,?]dodeca-1(12),2(6),8,10-tetraene

CAS: 731802-63-4
Molecular Formula C15H18ClN3S
Molecular Weight 307.091 g/mol
LogP 3.8193
Topological Polar Surface Area 29.02 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 4
Rotatable Bonds 2
Exact Mass 307.091
Monoisotopic Mass 307.091
Heavy Atoms 20
Complexity 646.0963

Chemical Identifiers

CAS Number 731802-63-4
SMILES C1CCN(CC1)CC2=NC3=C(C4=C(S3)CCC4)C(=N2)Cl

Product Overview

AC1MSSCE (CAS 731802-63-4), with molecular formula C15H18ClN3S and molecular weight 307.091 g/mol. IUPAC: 12-chloro-10-(piperidin-1-ylmethyl)-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraene.

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