 Home > Encyclopedia > 5-(4-butoxyphenyl)-12,12-dimethyl-3-(2-phenylethylsulfanyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene

5-(4-butoxyphenyl)-12,12-dimethyl-3-(2-phenylethylsulfanyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene

5-(4-butoxyphenyl)-12,12-dimethyl-3-(2-phenylethylsulfanyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene structure

CAS No:
799823-87-3
Formula:
C29H32N2O2S2
Chemical Name:
5-(4-butoxyphenyl)-12,12-dimethyl-3-(2-phenylethylsulfanyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene
Synonyms:
ZINC2236855;STK549617;AKOS005477072;MCULE-8652762722;2-(4-butoxyphenyl)-6,6-dimethyl-4-[(2-phenylethyl)sulfanyl]-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine;799823-87-3

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5-(4-butoxyphenyl)-12,12-dimethyl-3-(2-phenylethylsulfanyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene Basic Attributes

Molecular Weight：

504.7 g/mol

Exact Mass：

504.19052061 g/mol

Characteristics

PSA：

97.8 Å²

Computed Properties

Molecular Weight:504.7
XLogP3:7.6
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:504.19052061
Monoisotopic Mass:504.19052061
Topological Polar Surface Area:97.8
Heavy Atom Count:35
Complexity:651
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Hot Searches: 2-naphthol reacting with naoh formula; d glucopyranose; butan-2-ol; 2-chlorobutane; 3-methyl-2-butanone; 1 3 bisphosphoglycerate

Guide of 5-(4-butoxyphenyl)-12,12-dimethyl-3-(2-phenylethylsulfanyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene

Basic Attributes
Characteristics
Computed Properties

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