 Home > Encyclopedia > 6-benzyl-5-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-13,13-dimethyl-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-7-one

6-benzyl-5-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-13,13-dimethyl-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-7-one

6-benzyl-5-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-13,13-dimethyl-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-7-one structure

CAS No:
351005-62-4
Formula:
C27H24BrN3O3S
Chemical Name:
6-benzyl-5-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-13,13-dimethyl-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-7-one
Synonyms:
Oprea1_253770;ZINC2254711;STK720974;AKOS005529619;MCULE-2788442758;3-benzyl-2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-8,8-dimethyl-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one;351005-62-4

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6-benzyl-5-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-13,13-dimethyl-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-7-one Basic Attributes

Molecular Weight：

550.5 g/mol

Exact Mass：

549.07218 g/mol

Characteristics

PSA：

97.2 Å²

Computed Properties

Molecular Weight:550.5
XLogP3:5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:6
Exact Mass:549.07218
Monoisotopic Mass:549.07218
Topological Polar Surface Area:97.2
Heavy Atom Count:35
Complexity:823
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 6-benzyl-5-[2-(4-bromophenyl)-2-oxoethyl]sulfanyl-13,13-dimethyl-12-oxa-2,4,6-triazatricyclo[8.4.0.03,8]tetradeca-1,3(8),4,9-tetraen-7-one

Basic Attributes
Characteristics
Computed Properties

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