 Home > Encyclopedia > 6-(4-bromophenyl)-N-(3-chlorophenyl)-2-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carboxamide

6-(4-bromophenyl)-N-(3-chlorophenyl)-2-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carboxamide

6-(4-bromophenyl)-N-(3-chlorophenyl)-2-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carboxamide structure

CAS No:
540773-96-4
Formula:
C28H22BrClN4O
Chemical Name:
6-(4-bromophenyl)-N-(3-chlorophenyl)-2-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carboxamide
Synonyms:
Oprea1_226224;ZINC2247601;STK770856;AKOS005615117;MCULE-5087624407;1-(4-bromophenyl)-N-(3-chlorophenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,3,4a-triazacyclopenta[cd]azulene-2-carboxamide;4-(4-bromophenyl)-N-(3-chlorophenyl)-1-phenyl-5,6,7,8-tetrahydro-2,2a,8a-triazacyclopenta[cd]azulene-3-carboxamide;540773-96-4

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6-(4-bromophenyl)-N-(3-chlorophenyl)-2-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carboxamide Basic Attributes

Molecular Weight：

545.9 g/mol

Exact Mass：

544.06655 g/mol

Characteristics

PSA：

51.3 Å²

Computed Properties

Molecular Weight:545.9
XLogP3:7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:544.06655
Monoisotopic Mass:544.06655
Topological Polar Surface Area:51.3
Heavy Atom Count:35
Complexity:743
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6-(4-bromophenyl)-N-(3-chlorophenyl)-2-phenyl-1,3,4-triazatricyclo[5.4.1.04,12]dodeca-2,5,7(12)-triene-5-carboxamide

Basic Attributes
Characteristics
Computed Properties

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