 Home > Encyclopedia > 4,4-dimethyl-13-(3-methylbutylsulfanyl)-8-propyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene

4,4-dimethyl-13-(3-methylbutylsulfanyl)-8-propyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene

4,4-dimethyl-13-(3-methylbutylsulfanyl)-8-propyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene structure

CAS No:
672892-82-9
Formula:
C22H29N3OS2
Chemical Name:
4,4-dimethyl-13-(3-methylbutylsulfanyl)-8-propyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene
Synonyms:
Oprea1_824727;ZINC1812090;STK544085;AKOS005473602;MCULE-8619797969;2,2-dimethyl-8-[(3-methylbutyl)sulfanyl]-5-propyl-1,4-dihydro-2H-pyrano[4'',3'':4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidine;672892-82-9

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4,4-dimethyl-13-(3-methylbutylsulfanyl)-8-propyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene Basic Attributes

Molecular Weight：

415.6 g/mol

Exact Mass：

415.17520490 g/mol

Characteristics

PSA：

101 Å²

Computed Properties

Molecular Weight:415.6
XLogP3:5.9
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:415.17520490
Monoisotopic Mass:415.17520490
Topological Polar Surface Area:101
Heavy Atom Count:28
Complexity:532
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4,4-dimethyl-13-(3-methylbutylsulfanyl)-8-propyl-5-oxa-11-thia-9,14,16-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(10),2(7),8,12(17),13,15-hexaene

Basic Attributes
Characteristics
Computed Properties

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