 Home > Encyclopedia > 5-(2-bromoprop-2-enylsulfanyl)-12,12-dimethyl-4-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

5-(2-bromoprop-2-enylsulfanyl)-12,12-dimethyl-4-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

5-(2-bromoprop-2-enylsulfanyl)-12,12-dimethyl-4-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one structure

CAS No:
372175-14-9
Formula:
C20H19BrN2O2S2
Chemical Name:
5-(2-bromoprop-2-enylsulfanyl)-12,12-dimethyl-4-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Synonyms:
ZINC2275282;STK698992;AKOS003595890;MCULE-5461799548;2-[(2-bromoprop-2-en-1-yl)sulfanyl]-6,6-dimethyl-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one;372175-14-9

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5-(2-bromoprop-2-enylsulfanyl)-12,12-dimethyl-4-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one Basic Attributes

Molecular Weight：

463.4 g/mol

Exact Mass：

462.00713 g/mol

Characteristics

PSA：

95.4 Å²

Computed Properties

Molecular Weight:463.4
XLogP3:4.9
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:462.00713
Monoisotopic Mass:462.00713
Topological Polar Surface Area:95.4
Heavy Atom Count:27
Complexity:648
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-(2-bromoprop-2-enylsulfanyl)-12,12-dimethyl-4-phenyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

Basic Attributes
Characteristics
Computed Properties

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