propan-2-yl 4-[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-3-oxobutanoate
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propan-2-yl 4-[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-3-oxobutanoate
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CAS No:
354556-39-1
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Formula:
C22H22N2O3S
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Chemical Name:
propan-2-yl 4-[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-3-oxobutanoate
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Synonyms:
BAS 07418025;ZINC1903419;RSC006173;STK840796;AKOS000670001;MCULE-6859694043;propan-2-yl 4-[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-3-oxobutanoate;354556-39-1
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CAS No:
propan-2-yl 4-[(3-cyano-4-phenyl-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]-3-oxobutanoate Basic Attributes
394.5 g/mol
394.13511374 g/mol
Computed Properties
Molecular Weight:394.5
XLogP3:4.3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:394.13511374
Monoisotopic Mass:394.13511374
Topological Polar Surface Area:105
Heavy Atom Count:28
Complexity:608
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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