 Home > Encyclopedia > 3-[(2-chlorophenyl)methylsulfanyl]-7-(4-methoxyphenyl)-12,12-dimethyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one

3-[(2-chlorophenyl)methylsulfanyl]-7-(4-methoxyphenyl)-12,12-dimethyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one

3-[(2-chlorophenyl)methylsulfanyl]-7-(4-methoxyphenyl)-12,12-dimethyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one structure

CAS No:
836641-64-6
Formula:
C26H23ClN4O3S2
Chemical Name:
3-[(2-chlorophenyl)methylsulfanyl]-7-(4-methoxyphenyl)-12,12-dimethyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one
Synonyms:
ZINC2251861;STK720465;AKOS005529050;MCULE-1398540382;1-((2-chlorobenzyl)thio)-4-(4-methoxyphenyl)-7,7-dimethyl-6,7-dihydro-4H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(9H)-one;1-[(2-chlorobenzyl)sulfanyl]-4-(4-methoxyphenyl)-7,7-dimethyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one;836641-64-6

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3-[(2-chlorophenyl)methylsulfanyl]-7-(4-methoxyphenyl)-12,12-dimethyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one Basic Attributes

Molecular Weight：

539.1 g/mol

Exact Mass：

538.0900106 g/mol

Characteristics

PSA：

123 Å²

Computed Properties

Molecular Weight:539.1
XLogP3:5.4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:538.0900106
Monoisotopic Mass:538.0900106
Topological Polar Surface Area:123
Heavy Atom Count:36
Complexity:816
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-[(2-chlorophenyl)methylsulfanyl]-7-(4-methoxyphenyl)-12,12-dimethyl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one

Basic Attributes
Characteristics
Computed Properties

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