ethyl 1-[2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)acetyl]piperidine-4-carboxylate
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ethyl 1-[2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)acetyl]piperidine-4-carboxylate
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CAS No:
722471-00-3
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Formula:
C19H23N3O3S2
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Chemical Name:
ethyl 1-[2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)acetyl]piperidine-4-carboxylate
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Synonyms:
ZINC3313441;AKOS033737233;MCULE-6091077921;Z20228669;722471-00-3;ethyl 1-(2-{7-thia-9,11-diazatricyclo[6.4.0.0^{2,6}]dodeca-1(12),2(6),8,10-tetraen-12-ylsulfanyl}acetyl)piperidine-4-carboxylate
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CAS No:
ethyl 1-[2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)acetyl]piperidine-4-carboxylate Basic Attributes
405.5 g/mol
405.11808395 g/mol
Computed Properties
Molecular Weight:405.5
XLogP3:3.3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:6
Exact Mass:405.11808395
Monoisotopic Mass:405.11808395
Topological Polar Surface Area:126
Heavy Atom Count:27
Complexity:556
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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