pentyl 2-[(7-butyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)sulfanyl]acetate
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pentyl 2-[(7-butyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)sulfanyl]acetate
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CAS No:
488133-94-4
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Formula:
C23H29N3O2S2
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Chemical Name:
pentyl 2-[(7-butyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)sulfanyl]acetate
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Synonyms:
ZINC8997310;STK721523;AKOS005529942;MCULE-5517789835;488133-94-4;pentyl [(4-butyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)sulfanyl]acetate
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CAS No:
pentyl 2-[(7-butyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl)sulfanyl]acetate Basic Attributes
443.6 g/mol
443.17011952 g/mol
Computed Properties
Molecular Weight:443.6
XLogP3:7
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:11
Exact Mass:443.17011952
Monoisotopic Mass:443.17011952
Topological Polar Surface Area:119
Heavy Atom Count:30
Complexity:567
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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