 Home > Encyclopedia > ethyl 4-(11-butyl-6-methyl-10,12-dioxo-4-phenyl-2,4,5,11,13-pentazatricyclo[7.4.0.03,7]trideca-1(13),3(7),5,8-tetraen-2-yl)benzoate

ethyl 4-(11-butyl-6-methyl-10,12-dioxo-4-phenyl-2,4,5,11,13-pentazatricyclo[7.4.0.03,7]trideca-1(13),3(7),5,8-tetraen-2-yl)benzoate

ethyl 4-(11-butyl-6-methyl-10,12-dioxo-4-phenyl-2,4,5,11,13-pentazatricyclo[7.4.0.03,7]trideca-1(13),3(7),5,8-tetraen-2-yl)benzoate structure

CAS No:
840477-58-9
Formula:
C28H27N5O4
Chemical Name:
ethyl 4-(11-butyl-6-methyl-10,12-dioxo-4-phenyl-2,4,5,11,13-pentazatricyclo[7.4.0.03,7]trideca-1(13),3(7),5,8-tetraen-2-yl)benzoate
Synonyms:
ZINC2263186;STK554696;AKOS005481212;MCULE-3682738969;840477-58-9;ethyl 4-(6-butyl-3-methyl-5,7-dioxo-1-phenyl-1,5,6,7-tetrahydro-9H-pyrazolo[4',3':5,6]pyrido[2,3-d]pyrimidin-9-yl)benzoate;ethyl 4-(6-butyl-3-methyl-5,7-dioxo-1-phenyl-6,7-dihydro-1H-pyrazolo[4',3':5,6]pyrido[2,3-d]pyrimidin-9(5H)-yl)benzoate

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ethyl 4-(11-butyl-6-methyl-10,12-dioxo-4-phenyl-2,4,5,11,13-pentazatricyclo[7.4.0.03,7]trideca-1(13),3(7),5,8-tetraen-2-yl)benzoate Basic Attributes

Molecular Weight：

497.5 g/mol

Exact Mass：

497.20630436 g/mol

Characteristics

PSA：

97.1 Å²

Computed Properties

Molecular Weight:497.5
XLogP3:4.8
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:497.20630436
Monoisotopic Mass:497.20630436
Topological Polar Surface Area:97.1
Heavy Atom Count:37
Complexity:950
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ethyl 4-(11-butyl-6-methyl-10,12-dioxo-4-phenyl-2,4,5,11,13-pentazatricyclo[7.4.0.03,7]trideca-1(13),3(7),5,8-tetraen-2-yl)benzoate

Basic Attributes
Characteristics
Computed Properties
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