Home Carboxys Methyl 6-n-boc-amino-3-formyl-1h-indole-4-carboxylate

Methyl 6-n-boc-amino-3-formyl-1h-indole-4-carboxylate

CAS No.:
731810-57-4
Catalog Number:
AG00FAYB
Molecular Formula:
C16H18N2O5
Molecular Weight:
318.3245
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$338
- +
1g
97%
1 week
United States
$788
- +
Product Description
Catalog Number:
AG00FAYB
Chemical Name:
Methyl 6-n-boc-amino-3-formyl-1h-indole-4-carboxylate
CAS Number:
731810-57-4
Molecular Formula:
C16H18N2O5
Molecular Weight:
318.3245
MDL Number:
MFCD09800496
IUPAC Name:
methyl 3-formyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]-1H-indole-4-carboxylate
InChI:
InChI=1S/C16H18N2O5/c1-16(2,3)23-15(21)18-10-5-11(14(20)22-4)13-9(8-19)7-17-12(13)6-10/h5-8,17H,1-4H3,(H,18,21)
InChI Key:
RJOLGXRDBFYRMF-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(NC(=O)OC(C)(C)C)cc2c1c(C=O)c[nH]2
Properties
Complexity:
474  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.122g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
318.329g/mol
Monoisotopic Mass:
318.122g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
97.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties