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2-{[2-(1-adamantyl)-2-oxoethyl]sulfanyl}-6-amino-4-(4-isopropoxy-3-methoxyphenyl)-3,5-pyridinedicarbonitrile

2-{[2-(1-adamantyl)-2-oxoethyl]sulfanyl}-6-amino-4-(4-isopropoxy-3-methoxyphenyl)-3,5-pyridinedicarbonitrile structure

CAS No:
340818-00-0
Formula:
C29H32N4O3S
Chemical Name:
2-{[2-(1-adamantyl)-2-oxoethyl]sulfanyl}-6-amino-4-(4-isopropoxy-3-methoxyphenyl)-3,5-pyridinedicarbonitrile
Synonyms:
2-{[2-(1-adamantyl)-2-oxoethyl]sulfanyl}-6-amino-4-(4-isopropoxy-3-methoxyphenyl)-3,5-pyridinedicarbonitrile;2-amino-4-[3-methoxy-4-(propan-2-yloxy)phenyl]-6-{[2-oxo-2-(tricyclo[3.3.1.1~3,7~]dec-1-yl)ethyl]sulfanyl}pyridine-3,5-dicarbonitrile;Oprea1_283061;AK-777/12226085;RSC007347;STK068546;ZINC19816381;AKOS003680224;MCULE-6839178139;ST51062268

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2-{[2-(1-adamantyl)-2-oxoethyl]sulfanyl}-6-amino-4-(4-isopropoxy-3-methoxyphenyl)-3,5-pyridinedicarbonitrile Basic Attributes

Molecular Weight：

516.65438

Exact Mass：

516.22

Characteristics

PSA：

147

XLogP3：

Computed Properties

Molecular Weight:516.7
XLogP3:6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:8
Exact Mass:516.21951207
Monoisotopic Mass:516.21951207
Topological Polar Surface Area:147
Heavy Atom Count:37
Complexity:912
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-{[2-(1-adamantyl)-2-oxoethyl]sulfanyl}-6-amino-4-(4-isopropoxy-3-methoxyphenyl)-3,5-pyridinedicarbonitrile

Basic Attributes
Characteristics
Computed Properties

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