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

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

CAS No.:
180258-48-4
Catalog Number:
AG01F2CF
Molecular Formula:
C14H22N4O5
Molecular Weight:
326.3483
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
1 week
United States
$138
- +
1g
1 week
United States
$239
- +
Product Description
Catalog Number:
AG01F2CF
Chemical Name:
4-(4-tert-Butoxycarbonylaminobutyrylamino) -1-methyl-1H-imidazole-2-carboxylic acid
CAS Number:
180258-48-4
Molecular Formula:
C14H22N4O5
Molecular Weight:
326.3483
MDL Number:
MFCD04116421
IUPAC Name:
1-methyl-4-[4-[(2-methylpropan-2-yl)oxycarbonylamino]butanoylamino]imidazole-2-carboxylic acid
InChI:
InChI=1S/C14H22N4O5/c1-14(2,3)23-13(22)15-7-5-6-10(19)16-9-8-18(4)11(17-9)12(20)21/h8H,5-7H2,1-4H3,(H,15,22)(H,16,19)(H,20,21)
InChI Key:
AXQWXPYKXIICHC-UHFFFAOYSA-N
SMILES:
O=C(Nc1nc(n(c1)C)C(=O)O)CCCNC(=O)OC(C)(C)C
Properties
Complexity:
449  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
326.159g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
326.353g/mol
Monoisotopic Mass:
326.159g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
123A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Properties