 Home > Encyclopedia > 5-butylsulfanyl-12,12-dimethyl-4-(4-methylphenyl)-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

5-butylsulfanyl-12,12-dimethyl-4-(4-methylphenyl)-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

5-butylsulfanyl-12,12-dimethyl-4-(4-methylphenyl)-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one structure

CAS No:
499209-91-5
Formula:
C22H26N2OS3
Chemical Name:
5-butylsulfanyl-12,12-dimethyl-4-(4-methylphenyl)-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Synonyms:
ZINC1782024;STK941529;AKOS005670586;MCULE-7839650956;2-(butylsulfanyl)-6,6-dimethyl-3-(4-methylphenyl)-3,5,6,8-tetrahydro-4H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one;499209-91-5

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5-butylsulfanyl-12,12-dimethyl-4-(4-methylphenyl)-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one Basic Attributes

Molecular Weight：

430.7 g/mol

Exact Mass：

430.12072698 g/mol

Characteristics

PSA：

112 Å²

Computed Properties

Molecular Weight:430.7
XLogP3:6.1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:430.12072698
Monoisotopic Mass:430.12072698
Topological Polar Surface Area:112
Heavy Atom Count:28
Complexity:615
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: smz tmp; methyl ethyl ketoxime; ch3cl; triiodide; oxalic acid formula; aluminum phosphate formula

Guide of 5-butylsulfanyl-12,12-dimethyl-4-(4-methylphenyl)-8,11-dithia-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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