 Home > Encyclopedia > 4-(2,5-dimethyl-1-phenylpyrrol-3-yl)-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene

4-(2,5-dimethyl-1-phenylpyrrol-3-yl)-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene

4-(2,5-dimethyl-1-phenylpyrrol-3-yl)-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene structure

CAS No:
380422-23-1
Formula:
C23H21N5S
Chemical Name:
4-(2,5-dimethyl-1-phenylpyrrol-3-yl)-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene
Synonyms:
ZINC3213628;AKOS034456639;MCULE-4420445087;Z56803518;380422-23-1;4-(2,5-dimethyl-1-phenyl-1H-pyrrol-3-yl)-10-thia-3,5,6,8-tetraazatetracyclo[7.7.0.0^{2,6}.0^{11,16}]hexadeca-1(9),2,4,7,11(16)-pentaene

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4-(2,5-dimethyl-1-phenylpyrrol-3-yl)-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene Basic Attributes

Molecular Weight：

399.5 g/mol

Exact Mass：

399.15176686 g/mol

Characteristics

PSA：

76.2 Å²

Computed Properties

Molecular Weight:399.5
XLogP3:5.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:399.15176686
Monoisotopic Mass:399.15176686
Topological Polar Surface Area:76.2
Heavy Atom Count:29
Complexity:598
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(2,5-dimethyl-1-phenylpyrrol-3-yl)-10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene

Basic Attributes
Characteristics
Computed Properties

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