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8-(4-chlorophenyl)-1,3-dimethyl-7H-purine-2,6-dione

8-(4-chlorophenyl)-1,3-dimethyl-7H-purine-2,6-dione structure

CAS No:
29064-02-6
Formula:
C13H11ClN4O2
Chemical Name:
8-(4-chlorophenyl)-1,3-dimethyl-7H-purine-2,6-dione
Synonyms:
NSC282471;CHEMBL269218;29064-02-6;SCHEMBL515588;8-(4-Chlorophenyl)theophylline;DTXSID60314392;BDBM50020988;PDSP1_001021;PDSP2_001005;STK697687;ZINC17105141;AKOS005520936;MCULE-1988647193;NSC-282471;8-(4-Chlorophenyl)-1,3-dimethylxanthine;DS-002975;8-(4-Chloro-phenyl)-1,3-dimethyl-3,7-dihydro-purine-2,6-dione;8-(4-chlorophenyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione;1H-PURINE-2,6-DIONE,8-(4-CHLOROPHENYL)-3,9-DIHYDRO-1,3-DIMETHYL-

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8-(4-chlorophenyl)-1,3-dimethyl-7H-purine-2,6-dione Basic Attributes

Molecular Weight：

290.70 g/mol

Exact Mass：

290.0570533 g/mol

NSC Number：

282471

DSSTox ID：

DTXSID60314392

Characteristics

PSA：

69.3 Å²

Computed Properties

Molecular Weight:290.70
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:290.0570533
Monoisotopic Mass:290.0570533
Topological Polar Surface Area:69.3
Heavy Atom Count:20
Complexity:425
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 8-(4-chlorophenyl)-1,3-dimethyl-7H-purine-2,6-dione

Basic Attributes
Characteristics
Computed Properties

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