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153429-58-4

153429-58-4 | 1,3,5-Triazine, 2-(1H-imidazol-1-yl)-4-(4-morpholinyl)-6-(3-thiazolidinyl)-

CAS No: 153429-58-4 Catalog No: AG007Y59 MDL No:

Product Description

Catalog Number:
AG007Y59
Chemical Name:
1,3,5-Triazine, 2-(1H-imidazol-1-yl)-4-(4-morpholinyl)-6-(3-thiazolidinyl)-
CAS Number:
153429-58-4
Molecular Formula:
C13H17N7OS
Molecular Weight:
319.3854
IUPAC Name:
4-[4-imidazol-1-yl-6-(1,3-thiazolidin-3-yl)-1,3,5-triazin-2-yl]morpholine
InChI:
InChI=1S/C13H17N7OS/c1-2-19(9-14-1)12-15-11(18-3-6-21-7-4-18)16-13(17-12)20-5-8-22-10-20/h1-2,9H,3-8,10H2
InChI Key:
MFGRHTOXRFZEMI-UHFFFAOYSA-N
SMILES:
O1CCN(CC1)c1nc(nc(n1)n1ccnc1)N1CCSC1

Properties

Complexity:
370  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.122g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
319.387g/mol
Monoisotopic Mass:
319.122g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
97.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

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