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Home > Encyclopedia > 4-(BENZYLAMINO)-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLIC ACID

4-(BENZYLAMINO)-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLIC ACID

4-(BENZYLAMINO)-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLIC ACID structure

4-(BENZYLAMINO)-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLIC ACID 

structure
  • CAS No:

    686267-34-5

  • Formula:

    C13H13N3O2S

  • Chemical Name:

    4-(BENZYLAMINO)-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLIC ACID

  • Synonyms:

    4-(Benzylamino)-2-(methylthio)pyrimidine-5-carboxylic acid;4-(benzylamino)-2-(methylsulfanyl)pyrimidine-5-carboxylic acid;SCHEMBL1522370;CTK1J1899;DTXSID20651790;0595AC;ZINC20385514;AKOS015938702;MCULE-5332261191;DB-074049

4-(BENZYLAMINO)-2-(METHYLTHIO)PYRIMIDINE-5-CARBOXYLIC ACID Basic Attributes

275.326

275.07300

DTXSID20651790

2933599090

Characteristics

100

2.58180

1.372g/cm3

502.28ºC at 760 mmHg

257.57ºC

1.662

Computed Properties

Molecular Weight:275.33
XLogP3:2.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:275.07284784
Monoisotopic Mass:275.07284784
Topological Polar Surface Area:100
Heavy Atom Count:19
Complexity:298
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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