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

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

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

CAS No:
799793-99-0
Formula:
C28H38N2O2S2
Chemical Name:
5-(4-butoxyphenyl)-3-heptylsulfanyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene
Synonyms:
C28H38N2O2S2;ZINC2219716;STK720792;AKOS005529635;MCULE-3907879626;2-(4-butoxyphenyl)-4-(heptylsulfanyl)-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine;799793-99-0

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

Molecular Weight：

498.7 g/mol

Exact Mass：

498.23747081 g/mol

Characteristics

PSA：

97.8 Å²

Computed Properties

Molecular Weight:498.7
XLogP3:8.5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:12
Exact Mass:498.23747081
Monoisotopic Mass:498.23747081
Topological Polar Surface Area:97.8
Heavy Atom Count:34
Complexity:599
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-(4-butoxyphenyl)-3-heptylsulfanyl-12,12-dimethyl-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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