 Home > Encyclopedia > diethyl 2-[10-(4-methylanilino)-8-oxo-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaen-12-yl]propanedioate

diethyl 2-[10-(4-methylanilino)-8-oxo-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaen-12-yl]propanedioate

diethyl 2-[10-(4-methylanilino)-8-oxo-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaen-12-yl]propanedioate structure

CAS No:
105897-10-7
Formula:
C28H24N2O6
Chemical Name:
diethyl 2-[10-(4-methylanilino)-8-oxo-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaen-12-yl]propanedioate
Synonyms:
ZINC8921276;STK846196;STK998140;ZINC57294899;AKOS001588201;AKOS005626982;MCULE-6220552859;SR-01000390682;SR-01000390682-1;diethyl {5-[(4-methylphenyl)amino]-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-3-yl}propanedioate;diethyl {5-[(4-methylphenyl)amino]-6-oxo-6H-anthra[1,9-cd]isoxazol-3-yl}malonate;105897-10-7;diethyl {(5E)-6-hydroxy-5-[(4-methylphenyl)imino]-5H-anthra[1,9-cd][1,2]oxazol-3-yl}propanedioate

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diethyl 2-[10-(4-methylanilino)-8-oxo-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaen-12-yl]propanedioate Basic Attributes

Molecular Weight：

484.5 g/mol

Exact Mass：

484.16343649 g/mol

Characteristics

PSA：

108 Å²

XLogP3：

5.374

Melting Point：

186 °C (heptane)

Computed Properties

Molecular Weight:484.5
XLogP3:6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:9
Exact Mass:484.16343649
Monoisotopic Mass:484.16343649
Topological Polar Surface Area:108
Heavy Atom Count:36
Complexity:809
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of diethyl 2-[10-(4-methylanilino)-8-oxo-15-oxa-14-azatetracyclo[7.6.1.02,7.013,16]hexadeca-1(16),2,4,6,9,11,13-heptaen-12-yl]propanedioate

Basic Attributes
Characteristics
Computed Properties
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