 Home > Encyclopedia > 4-(3-chlorophenyl)-12,12-dimethyl-6-(2-methylprop-2-enyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-diene-3,5-dione

4-(3-chlorophenyl)-12,12-dimethyl-6-(2-methylprop-2-enyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-diene-3,5-dione

4-(3-chlorophenyl)-12,12-dimethyl-6-(2-methylprop-2-enyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-diene-3,5-dione structure

CAS No:
713113-74-7
Formula:
C21H21ClN2O3S
Chemical Name:
4-(3-chlorophenyl)-12,12-dimethyl-6-(2-methylprop-2-enyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-diene-3,5-dione
Synonyms:
3-(3-chlorophenyl)-6,6-dimethyl-1-(2-methylprop-2-en-1-yl)-1,5,6,8-tetrahydro-2H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione;ZINC2213992;STL226919;AKOS001491873;MCULE-4428028949;713113-74-7

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4-(3-chlorophenyl)-12,12-dimethyl-6-(2-methylprop-2-enyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-diene-3,5-dione Basic Attributes

Molecular Weight：

416.9 g/mol

Exact Mass：

416.0961414 g/mol

Characteristics

PSA：

78.1 Å²

Computed Properties

Molecular Weight:416.9
XLogP3:4.6
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:416.0961414
Monoisotopic Mass:416.0961414
Topological Polar Surface Area:78.1
Heavy Atom Count:28
Complexity:685
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-(3-chlorophenyl)-12,12-dimethyl-6-(2-methylprop-2-enyl)-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7)-diene-3,5-dione

Basic Attributes
Characteristics
Computed Properties

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