Home Carbonyls Benzyl (3S)-3-{[(benzyloxy)carbonyl]amino}-3-{[(2R)-1-methoxy-1-oxo-3-phenylpropan-2-yl]carbamoyl}propanoate

Benzyl (3S)-3-{[(benzyloxy)carbonyl]amino}-3-{[(2R)-1-methoxy-1-oxo-3-phenylpropan-2-yl]carbamoyl}propanoate

CAS No.:
22839-58-3
Catalog Number:
AG01F2KU
Molecular Formula:
C29H30N2O7
Molecular Weight:
518.5577
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
90%
1 week
United States
$309
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Product Description
Catalog Number:
AG01F2KU
Chemical Name:
Benzyl (3S)-3-{[(benzyloxy)carbonyl]amino}-3-{[(2R)-1-methoxy-1-oxo-3-phenylpropan-2-yl]carbamoyl}propanoate
CAS Number:
22839-58-3
Molecular Formula:
C29H30N2O7
Molecular Weight:
518.5577
MDL Number:
MFCD03837531
IUPAC Name:
benzyl (3S)-4-[[(2R)-1-methoxy-1-oxo-3-phenylpropan-2-yl]amino]-4-oxo-3-(phenylmethoxycarbonylamino)butanoate
InChI:
InChI=1S/C29H30N2O7/c1-36-28(34)25(17-21-11-5-2-6-12-21)30-27(33)24(18-26(32)37-19-22-13-7-3-8-14-22)31-29(35)38-20-23-15-9-4-10-16-23/h2-16,24-25H,17-20H2,1H3,(H,30,33)(H,31,35)/t24-,25+/m0/s1
InChI Key:
IVJGBERAZUMDJM-LOSJGSFVSA-N
SMILES:
COC(=O)[C@H](NC(=O)[C@@H](NC(=O)OCc1ccccc1)CC(=O)OCc1ccccc1)Cc1ccccc1
Properties
Complexity:
756  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
518.205g/mol
Formal Charge:
0
Heavy Atom Count:
38  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
518.566g/mol
Monoisotopic Mass:
518.205g/mol
Rotatable Bond Count:
15  
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties