C26H21ClN4O3S2 structure

C26H21ClN4O3S2

N-(4-chlorophenyl)-2-[[8-(furan-2-yl)-4,4-dimethyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-yl]sulfanyl]acetamide

Also Known As: N-(4-chlorophenyl)-2-((5-(furan-2-yl)-2,2-dimethyl-2,4-dihydro-1H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl)thio)acetamide|N-(4-chlorophenyl)-2-{[5-(furan-2-yl)-2,2-dimethyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-8-yl]sulfanyl}acetamide

CAS: 836634-05-0
Molecular Formula C26H21ClN4O3S2
Molecular Weight 536.07434 g/mol
LogP 6.735
Topological Polar Surface Area 90.14 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 8
Rotatable Bonds 5
Exact Mass 536.07434
Monoisotopic Mass 536.07434
Heavy Atoms 36
Complexity 1597.8636

Chemical Identifiers

CAS Number 836634-05-0
SMILES CC1(CC2=C(CO1)C(=NC3=C2C4=C(S3)C(=NC=N4)SCC(=O)NC5=CC=C(C=C5)Cl)C6=CC=CO6)C

Product Overview

C26H21ClN4O3S2 (CAS 836634-05-0), with molecular formula C26H21ClN4O3S2 and molecular weight 536.07434 g/mol. IUPAC: N-(4-chlorophenyl)-2-[[8-(furan-2-yl)-4,4-dimethyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaen-13-yl]sulfanyl]acetamide.

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