 Home > Encyclopedia > 13-(3-methylbutyl)-17-(2-phenylethyl)-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-12-one

13-(3-methylbutyl)-17-(2-phenylethyl)-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-12-one

13-(3-methylbutyl)-17-(2-phenylethyl)-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-12-one structure

CAS No:
848058-17-3
Formula:
C25H25N5O
Chemical Name:
13-(3-methylbutyl)-17-(2-phenylethyl)-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-12-one
Synonyms:
ZINC2421247;STL225925;AKOS025272050;MCULE-8674202888;3-(3-methylbutyl)-11-(2-phenylethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one;848058-17-3

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13-(3-methylbutyl)-17-(2-phenylethyl)-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-12-one Basic Attributes

Molecular Weight：

411.5 g/mol

Exact Mass：

411.20591044 g/mol

Characteristics

PSA：

63.4 Å²

Computed Properties

Molecular Weight:411.5
XLogP3:4.6
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:411.20591044
Monoisotopic Mass:411.20591044
Topological Polar Surface Area:63.4
Heavy Atom Count:31
Complexity:660
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 13-(3-methylbutyl)-17-(2-phenylethyl)-2,9,13,15,17-pentazatetracyclo[8.7.0.03,8.011,16]heptadeca-1,3,5,7,9,11(16),14-heptaen-12-one

Basic Attributes
Characteristics
Computed Properties

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