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2045-25-2

2045-25-2 | 1,3,5-Triazin-2-amine, 4-(4-morpholinyl)-

CAS No: 2045-25-2 Catalog No: AG0029JI MDL No:MFCD00023307

Product Description

Catalog Number:
AG0029JI
Chemical Name:
1,3,5-Triazin-2-amine, 4-(4-morpholinyl)-
CAS Number:
2045-25-2
Molecular Formula:
C7H11N5O
Molecular Weight:
181.1951
MDL Number:
MFCD00023307
IUPAC Name:
4-morpholin-4-yl-1,3,5-triazin-2-amine
InChI:
InChI=1S/C7H11N5O/c8-6-9-5-10-7(11-6)12-1-3-13-4-2-12/h5H,1-4H2,(H2,8,9,10,11)
InChI Key:
QEJUSHCHCOTTPE-UHFFFAOYSA-N
SMILES:
Nc1ncnc(n1)N1CCOCC1
NSC Number:
109885

Properties

Complexity:
161  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.096g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.199g/mol
Monoisotopic Mass:
181.096g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
77.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3  

Literature

Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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