Home Carboxys 4-(6-CyclopropylaMino-pyriMidin-4-ylaMino)-piperidine-1-carboxylic acid tert-butyl ester

4-(6-CyclopropylaMino-pyriMidin-4-ylaMino)-piperidine-1-carboxylic acid tert-butyl ester

CAS No.:
1353946-67-4
Catalog Number:
AG009I2T
Molecular Formula:
C17H27N5O2
Molecular Weight:
333.4286
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$164
- +
250mg
95%
In Stock USA
United States
$250
- +
Product Description
Catalog Number:
AG009I2T
Chemical Name:
4-(6-CyclopropylaMino-pyriMidin-4-ylaMino)-piperidine-1-carboxylic acid tert-butyl ester
CAS Number:
1353946-67-4
Molecular Formula:
C17H27N5O2
Molecular Weight:
333.4286
MDL Number:
MFCD21098660
IUPAC Name:
tert-butyl 4-[[6-(cyclopropylamino)pyrimidin-4-yl]amino]piperidine-1-carboxylate
InChI:
InChI=1S/C17H27N5O2/c1-17(2,3)24-16(23)22-8-6-13(7-9-22)21-15-10-14(18-11-19-15)20-12-4-5-12/h10-13H,4-9H2,1-3H3,(H2,18,19,20,21)
InChI Key:
NTCWZFAZKUDWCW-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(CC1)Nc1ncnc(c1)NC1CC1)OC(C)(C)C
Properties
Complexity:
427  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.216g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
333.436g/mol
Monoisotopic Mass:
333.216g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
79.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties