 Home > Encyclopedia > 7-butyl-12-(2,2-diethoxyethylsulfanyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene

7-butyl-12-(2,2-diethoxyethylsulfanyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene

7-butyl-12-(2,2-diethoxyethylsulfanyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene structure

CAS No:
799818-38-5
Formula:
C22H29N3O2S2
Chemical Name:
7-butyl-12-(2,2-diethoxyethylsulfanyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene
Synonyms:
ZINC2233826;AKOS030520879;MCULE-5990336365;799818-38-5

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7-butyl-12-(2,2-diethoxyethylsulfanyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene Basic Attributes

Molecular Weight：

431.6 g/mol

Exact Mass：

431.17011952 g/mol

Characteristics

PSA：

111 Å²

Computed Properties

Molecular Weight:431.6
XLogP3:5.9
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:431.17011952
Monoisotopic Mass:431.17011952
Topological Polar Surface Area:111
Heavy Atom Count:29
Complexity:508
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 7-butyl-12-(2,2-diethoxyethylsulfanyl)-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaene

Basic Attributes
Characteristics
Computed Properties

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