pentyl 2-[(7-ethyl-14,14-dimethyl-13-oxa-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]acetate
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pentyl 2-[(7-ethyl-14,14-dimethyl-13-oxa-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]acetate
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CAS No:
799790-42-4
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Formula:
C21H28N4O3S2
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Chemical Name:
pentyl 2-[(7-ethyl-14,14-dimethyl-13-oxa-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]acetate
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Synonyms:
ZINC2214857;STK553256;AKOS005480141;MCULE-1142928769;799790-42-4;pentyl [(5-ethyl-10,10-dimethyl-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]acetate
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CAS No:
pentyl 2-[(7-ethyl-14,14-dimethyl-13-oxa-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]acetate Basic Attributes
448.6 g/mol
448.16028312 g/mol
Computed Properties
Molecular Weight:448.6
XLogP3:5.6
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:9
Exact Mass:448.16028312
Monoisotopic Mass:448.16028312
Topological Polar Surface Area:132
Heavy Atom Count:30
Complexity:611
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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