200,000+ products from a single source!
sales@angenechem.com
1217601-60-9 | (2S)-N-(2-Boc-amino-3-phenyl-d5-propyl) Boc-glycine
CAS No: 1217601-60-9 Catalog No: AG0015TT MDL No:
Product Description
Catalog Number:
AG0015TT
Chemical Name:
(2S)-N-(2-Boc-amino-3-phenyl-d5-propyl) Boc-glycine
CAS Number:
1217601-60-9
Molecular Formula:
C21H27D5N2O6
Molecular Weight:
413.5194
IUPAC Name:
2-[(2-methylpropan-2-yl)oxycarbonyl-[(2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(2,3,4,5,6-pentadeuteriophenyl)propyl]amino]acetic acid
InChI:
InChI=1S/C21H32N2O6/c1-20(2,3)28-18(26)22-16(12-15-10-8-7-9-11-15)13-23(14-17(24)25)19(27)29-21(4,5)6/h7-11,16H,12-14H2,1-6H3,(H,22,26)(H,24,25)/t16-/m0/s1/i7D,8D,9D,10D,11D
InChI Key:
BGBLTXIOYFGHND-CEVFZTSHSA-N
SMILES:
OC(=O)CN(C(=O)OC(C)(C)C)C[C@H](Cc1c([2H])c([2H])c(c(c1[2H])[2H])[2H])NC(=O)OC(C)(C)C
Properties
Complexity:
559
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
413.257g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
5
Molecular Weight:
413.526g/mol
Monoisotopic Mass:
413.257g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.