Home Carboxys 4-(3-tert-Butoxycarbonylaminopropionylamino) -1-methyl-1H-imidazole-2-carboxylic acid

4-(3-tert-Butoxycarbonylaminopropionylamino) -1-methyl-1H-imidazole-2-carboxylic acid

CAS No.:
344779-17-5
Catalog Number:
AG01F2BI
Molecular Formula:
C13H20N4O5
Molecular Weight:
312.3217
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$137
- +
1g
95%
1 week
United States
$239
- +
5g
95%
1 week
United States
$642
- +
Product Description
Catalog Number:
AG01F2BI
Chemical Name:
4-(3-tert-Butoxycarbonylaminopropionylamino) -1-methyl-1H-imidazole-2-carboxylic acid
CAS Number:
344779-17-5
Molecular Formula:
C13H20N4O5
Molecular Weight:
312.3217
MDL Number:
MFCD04116420
IUPAC Name:
1-methyl-4-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoylamino]imidazole-2-carboxylic acid
InChI:
InChI=1S/C13H20N4O5/c1-13(2,3)22-12(21)14-6-5-9(18)15-8-7-17(4)10(16-8)11(19)20/h7H,5-6H2,1-4H3,(H,14,21)(H,15,18)(H,19,20)
InChI Key:
MGYNKSFQJAIIPH-UHFFFAOYSA-N
SMILES:
O=C(Nc1nc(n(c1)C)C(=O)O)CCNC(=O)OC(C)(C)C
Properties
Complexity:
435  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.143g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
312.326g/mol
Monoisotopic Mass:
312.143g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
123A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties