Home Nitros Ala-ala-phe p-nitroanilide

Ala-ala-phe p-nitroanilide

CAS No.:
61043-41-2
Catalog Number:
AG00EC6Z
Molecular Formula:
C21H25N5O5
Molecular Weight:
427.4537
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
50mg
≥ 99% (Assay)
1 week
United States
$111
- +
100mg
≥ 99% (Assay)
1 week
United States
$170
- +
250mg
≥ 99% (Assay)
1 week
United States
$316
- +
1g
≥ 99% (Assay)
1 week
United States
$1098
- +
Product Description
Catalog Number:
AG00EC6Z
Chemical Name:
Ala-ala-phe p-nitroanilide
CAS Number:
61043-41-2
Molecular Formula:
C21H25N5O5
Molecular Weight:
427.4537
MDL Number:
MFCD00057666
IUPAC Name:
(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]propanoyl]amino]-N-(4-nitrophenyl)-3-phenylpropanamide
InChI:
InChI=1S/C21H25N5O5/c1-13(22)19(27)23-14(2)20(28)25-18(12-15-6-4-3-5-7-15)21(29)24-16-8-10-17(11-9-16)26(30)31/h3-11,13-14,18H,12,22H2,1-2H3,(H,23,27)(H,24,29)(H,25,28)/t13-,14-,18-/m0/s1
InChI Key:
RMYMOVDNWWDGFU-DEYYWGMASA-N
SMILES:
C[C@@H](C(=O)N[C@H](C(=O)Nc1ccc(cc1)[N+](=O)[O-])Cc1ccccc1)NC(=O)[C@@H](N)C
Properties
Complexity:
639  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Defined Bond Stereocenter Count:
0
Exact Mass:
427.186g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
427.461g/mol
Monoisotopic Mass:
427.186g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
159A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties