 Home > Encyclopedia > 1-(4-chlorophenyl)-2-[(5-ethyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]ethanone

1-(4-chlorophenyl)-2-[(5-ethyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]ethanone

1-(4-chlorophenyl)-2-[(5-ethyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]ethanone structure

CAS No:
497868-22-1
Formula:
C21H21ClN2O2S2
Chemical Name:
1-(4-chlorophenyl)-2-[(5-ethyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]ethanone
Synonyms:
ZINC2347128;STK546012;AKOS005474722;MCULE-8901491141;1-(4-chlorophenyl)-2-[(2-ethyl-6,6-dimethyl-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)sulfanyl]ethanone;497868-22-1

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1-(4-chlorophenyl)-2-[(5-ethyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]ethanone Basic Attributes

Molecular Weight：

433.0 g/mol

Exact Mass：

432.0732980 g/mol

Characteristics

PSA：

106 Å²

Computed Properties

Molecular Weight:433.0
XLogP3:5.6
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:432.0732980
Monoisotopic Mass:432.0732980
Topological Polar Surface Area:106
Heavy Atom Count:28
Complexity:571
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-(4-chlorophenyl)-2-[(5-ethyl-12,12-dimethyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraen-3-yl)sulfanyl]ethanone

Basic Attributes
Characteristics
Computed Properties

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