Home Carbonyls (R)-4-(Benzo[b]thiophen-3-yl)-3-((tert-butoxycarbonyl)amino)butanoic acid

(R)-4-(Benzo[b]thiophen-3-yl)-3-((tert-butoxycarbonyl)amino)butanoic acid

CAS No.:
190190-48-8
Catalog Number:
AG002EE2
Molecular Formula:
C17H21NO4S
Molecular Weight:
335.4179
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
≥ 99% (HPLC)
1 week
United States
$170
- +
250mg
≥ 99% (HPLC)
1 week
United States
$287
- +
Product Description
Catalog Number:
AG002EE2
Chemical Name:
(R)-4-(Benzo[b]thiophen-3-yl)-3-((tert-butoxycarbonyl)amino)butanoic acid
CAS Number:
190190-48-8
Molecular Formula:
C17H21NO4S
Molecular Weight:
335.4179
MDL Number:
MFCD01860943
IUPAC Name:
(3R)-4-(1-benzothiophen-3-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]butanoic acid
InChI:
InChI=1S/C17H21NO4S/c1-17(2,3)22-16(21)18-12(9-15(19)20)8-11-10-23-14-7-5-4-6-13(11)14/h4-7,10,12H,8-9H2,1-3H3,(H,18,21)(H,19,20)/t12-/m1/s1
InChI Key:
VRUFHPBCNHYEPJ-GFCCVEGCSA-N
SMILES:
OC(=O)C[C@@H](Cc1csc2c1cccc2)NC(=O)OC(C)(C)C
Properties
Complexity:
435  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
335.119g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
335.418g/mol
Monoisotopic Mass:
335.119g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties