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

12,12-dimethyl-4-(3-methylphenyl)-5-[(4-propan-2-yloxyphenyl)methylsulfanyl]-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one

12,12-dimethyl-4-(3-methylphenyl)-5-[(4-propan-2-yloxyphenyl)methylsulfanyl]-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one structure

CAS No:
500268-76-8
Formula:
C28H30N2O3S2
Chemical Name:
12,12-dimethyl-4-(3-methylphenyl)-5-[(4-propan-2-yloxyphenyl)methylsulfanyl]-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Synonyms:
ZINC1747643;STK720990;AKOS005529441;MCULE-5048147234;500268-76-8;6,6-dimethyl-3-(3-methylphenyl)-2-{[4-(propan-2-yloxy)benzyl]sulfanyl}-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one

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12,12-dimethyl-4-(3-methylphenyl)-5-[(4-propan-2-yloxyphenyl)methylsulfanyl]-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：

506.7 g/mol

Exact Mass：

506.16978517 g/mol

Characteristics

PSA：

105 Å²

Computed Properties

Molecular Weight:506.7
XLogP3:6.4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:506.16978517
Monoisotopic Mass:506.16978517
Topological Polar Surface Area:105
Heavy Atom Count:35
Complexity:795
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 12,12-dimethyl-4-(3-methylphenyl)-5-[(4-propan-2-yloxyphenyl)methylsulfanyl]-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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