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

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

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

CAS No:
713113-05-4
Formula:
C25H23ClN2O3S2
Chemical Name:
5-[(2-chlorophenyl)methylsulfanyl]-4-(4-methoxyphenyl)-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-3-one
Synonyms:
ZINC2234982;STK844021;AKOS005625887;MCULE-2268973446;2-[(2-chlorobenzyl)sulfanyl]-3-(4-methoxyphenyl)-6,6-dimethyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one;713113-05-4

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5-[(2-chlorophenyl)methylsulfanyl]-4-(4-methoxyphenyl)-12,12-dimethyl-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：

499.0 g/mol

Exact Mass：

498.0838626 g/mol

Characteristics

PSA：

105 Å²

Computed Properties

Molecular Weight:499.0
XLogP3:5.8
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:498.0838626
Monoisotopic Mass:498.0838626
Topological Polar Surface Area:105
Heavy Atom Count:33
Complexity:758
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-[(2-chlorophenyl)methylsulfanyl]-4-(4-methoxyphenyl)-12,12-dimethyl-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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