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1,3,7-trimethyl-8-phenoxypurine-2,6-dione

1,3,7-trimethyl-8-phenoxypurine-2,6-dione structure

CAS No:
6279-37-4
Formula:
C14H14N4O3
Chemical Name:
1,3,7-trimethyl-8-phenoxypurine-2,6-dione
Synonyms:
1,3,7-Trimethyl-8-phenoxy-3,7-dihydro-purine-2,6-dione;MLS000737946;CHEMBL1529697;1,3,7-trimethyl-8-phenoxy-3,7-dihydro-1H-purine-2,6-dione;6279-37-4;SMR000140944;8-Phenoxycaffeine;NSC11296;CBMicro_009685;ChemDiv2_004544;Oprea1_323374;MLS000533506;ZINC93738;DTXSID20279110;HMS1381O12;HMS2182P11;SMSF0011031;BDBM50348833;CCG-22654;NSC-11296;STK804473;AKOS000647207;CB12509;MCULE-4505744875;IDI1_003259;BIM-0009675.P001;ST50254266;1,3,7-trimethyl-8-phenoxy-1,3,7-trihydropurine-2,6-dione

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1,3,7-trimethyl-8-phenoxypurine-2,6-dione Basic Attributes

Molecular Weight：

286.29 g/mol

Exact Mass：

286.10659032 g/mol

NSC Number：

11296

DSSTox ID：

DTXSID20279110

Characteristics

PSA：

67.7 Å²

Computed Properties

Molecular Weight:286.29
XLogP3:1.4
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:286.10659032
Monoisotopic Mass:286.10659032
Topological Polar Surface Area:67.7
Heavy Atom Count:21
Complexity:438
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,3,7-trimethyl-8-phenoxypurine-2,6-dione

Basic Attributes
Characteristics
Computed Properties

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