 Home > Encyclopedia > 7-butyl-12-[(2-chlorophenyl)methylsulfanyl]-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-chlorophenyl)methylsulfanyl]-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-chlorophenyl)methylsulfanyl]-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:
799808-31-4
Formula:
C23H22ClN3S2
Chemical Name:
7-butyl-12-[(2-chlorophenyl)methylsulfanyl]-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:
ZINC2229116;AKOS030520676;MCULE-5826138683;799808-31-4

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7-butyl-12-[(2-chlorophenyl)methylsulfanyl]-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：

440.0 g/mol

Exact Mass：

439.0943678 g/mol

Characteristics

PSA：

92.2 Å²

Computed Properties

Molecular Weight:440.0
XLogP3:7.4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:439.0943678
Monoisotopic Mass:439.0943678
Topological Polar Surface Area:92.2
Heavy Atom Count:29
Complexity:552
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 7-butyl-12-[(2-chlorophenyl)methylsulfanyl]-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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