2,9-DIAZA-10-(2-CHLORO-6-FLUOROPHENYL)-14,14-DIMETHYL-12-OXOTRICYCLO[9.4.0.0(3,8)]PENTADECA-1(11),3(8),4,6-TETRAENE-5-CARBOXYLIC ACID
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![2,9-DIAZA-10-(2-CHLORO-6-FLUOROPHENYL)-14,14-DIMETHYL-12-OXOTRICYCLO[9.4.0.0(3,8)]PENTADECA-1(11),3(8),4,6-TETRAENE-5-CARBOXYLIC ACID structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/914e99108d5a4c86b0491a40725c436d.png "2,9-DIAZA-10-(2-CHLORO-6-FLUOROPHENYL)-14,14-DIMETHYL-12-OXOTRICYCLO[9.4.0.0(3,8)]PENTADECA-1(11),3(8),4,6-TETRAENE-5-CARBOXYLIC ACID")
2,9-DIAZA-10-(2-CHLORO-6-FLUOROPHENYL)-14,14-DIMETHYL-12-OXOTRICYCLO[9.4.0.0(3,8)]PENTADECA-1(11),3(8),4,6-TETRAENE-5-CARBOXYLIC ACID
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CAS No:
946386-64-7
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Formula:
C22H20ClFN2O3
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Chemical Name:
2,9-DIAZA-10-(2-CHLORO-6-FLUOROPHENYL)-14,14-DIMETHYL-12-OXOTRICYCLO[9.4.0.0(3,8)]PENTADECA-1(11),3(8),4,6-TETRAENE-5-CARBOXYLIC ACID
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Synonyms:
2,9-DIAZA-10-(2-CHLORO-6-FLUOROPHENYL)-14,14-DIMETHYL-12-OXOTRICYCLO[9.4.0.0(3,8)]PENTADECA-1(11),3(8),4,6-TETRAENE-5-CARBOXYLIC ACID;10-(2-chloro-6-fluorophenyl)-14,14-dimethyl-12-oxo-2,9-diazatricyclo[9.4.0.0^{3,8}]pentadeca-1(11),3(8),4,6-tetraene-5-carboxylic acid
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CAS No:
2,9-DIAZA-10-(2-CHLORO-6-FLUOROPHENYL)-14,14-DIMETHYL-12-OXOTRICYCLO[9.4.0.0(3,8)]PENTADECA-1(11),3(8),4,6-TETRAENE-5-CARBOXYLIC ACID Basic Attributes
414.86
414.115
Computed Properties
Molecular Weight:414.9
XLogP3:4.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:414.1146484
Monoisotopic Mass:414.1146484
Topological Polar Surface Area:78.4
Heavy Atom Count:29
Complexity:725
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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