5-[(3,5-Diethoxyphenyl)methyl]pyrimidine-2,4-diamine

Base Information

• Chemical Name: 5-[(3,5-Diethoxyphenyl)methyl]pyrimidine-2,4-diamine
• CAS No.: 100515-03-5
• Molecular Formula: C15H20N4O2
• Molecular Weight: 288.34500
• ChEMBL ID: CHEMBL60913
• DSSTox Substance ID: DTXSID50566747
• Nikkaji Number: J360.448I
• Wikidata: Q82452501
• Mol file: 100515-03-5.mol

Synonyms:100515-03-5;5-[(3,5-Diethoxyphenyl)methyl]pyrimidine-2,4-diamine;CHEMBL60913;5-[(3,5-Diethoxyphenyl)methyl]-2,4-pyrimidinediamine;DTXSID50566747;BDBM50405989

Chemical Property of 5-[(3,5-Diethoxyphenyl)methyl]pyrimidine-2,4-diamine

Chemical Property:

• PSA: 96.28000
• LogP: 3.19160
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 288.15862589
• Heavy Atom Count: 21
• Complexity: 291

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC1=CC(=CC(=C1)CC2=CN=C(N=C2N)N)OCC

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