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Bz-his-ome

CAS No.:
3005-62-7
Catalog Number:
AG00BDGY
Molecular Formula:
C14H15N3O3
Molecular Weight:
273.2872
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
99%
In Stock USA
United States
$173
- +
25g
99%
In Stock USA
United States
$379
- +
Product Description
Catalog Number:
AG00BDGY
Chemical Name:
Bz-his-ome
CAS Number:
3005-62-7
Molecular Formula:
C14H15N3O3
Molecular Weight:
273.2872
MDL Number:
MFCD00153442
IUPAC Name:
methyl (2S)-2-benzamido-3-(1H-imidazol-5-yl)propanoate
InChI:
InChI=1S/C14H15N3O3/c1-20-14(19)12(7-11-8-15-9-16-11)17-13(18)10-5-3-2-4-6-10/h2-6,8-9,12H,7H2,1H3,(H,15,16)(H,17,18)/t12-/m0/s1
InChI Key:
POUMRJPRROOAGQ-LBPRGKRZSA-N
SMILES:
COC(=O)[C@@H](NC(=O)c1ccccc1)Cc1c[nH]cn1 C14H15N3O3
Properties
Complexity:
343  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
273.111g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
273.292g/mol
Monoisotopic Mass:
273.111g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
84.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties