5-Pyrimidinecarboxamide, N-((1-benzyl-2-pyrrolidinyl)methyl)-4-methoxy-2-methyl-, maleate, hydrate (2:3:2)

Base Information

• Chemical Name: 5-Pyrimidinecarboxamide, N-((1-benzyl-2-pyrrolidinyl)methyl)-4-methoxy-2-methyl-, maleate, hydrate (2:3:2)
• CAS No.: 84332-28-5
• Molecular Formula: C50H60N8O16
• Molecular Weight: 1065.09
• Mol file: 84332-28-5.mol

Synonyms:84332-28-5;5-Pyrimidinecarboxamide, N-((1-benzyl-2-pyrrolidinyl)methyl)-4-methoxy-2-methyl-, maleate, hydrate (2:3:2);C19H24N4O2.3/2C4H4O4.H2O;C19-H24-N4-O2.3/2C4-H4-O4.H2-O;LS-134787

Chemical Property of 5-Pyrimidinecarboxamide, N-((1-benzyl-2-pyrrolidinyl)methyl)-4-methoxy-2-methyl-, maleate, hydrate (2:3:2)

Chemical Property:

• Vapor Pressure: 1.05E-10mmHg at 25°C
• Boiling Point: 514.8°C at 760 mmHg
• Flash Point: 265.1°C
• PSA: 365.48000
• LogP: 4.53680
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 22
• Rotatable Bond Count: 18
• Exact Mass: 1028.41272786
• Heavy Atom Count: 74
• Complexity: 547

Purity/Quality:

5-PYRIMIDINECARBOXAMIDE, N-((1-BENZYL-2-PYRROLIDINYL)METHYL)-4-METHOXY-2-METHYL-, MALEATE, HYDRATE (2:3:2) 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC=C(C(=N1)OC)C(=O)NCC2CCCN2CC3=CC=CC=C3.CC1=NC=C(C(=N1)OC)C(=O)NCC2CCCN2CC3=CC=CC=C3.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O.C(=CC(=O)O)C(=O)O
• Isomeric SMILES: CC1=NC=C(C(=N1)OC)C(=O)NCC2N(CCC2)CC3=CC=CC=C3.CC1=NC=C(C(=N1)OC)C(=O)NCC2N(CCC2)CC3=CC=CC=C3.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O.C(=C\C(=O)O)\C(=O)O