200,000+ products from a single source!
sales@angenechem.com
Home > Thiazole > 1217628-22-2
1217628-22-2 | Boc-(S)-alpha-(4-thiazolylmethyl)-proline
CAS No: 1217628-22-2 Catalog No: AG018PWK MDL No:MFCD06659366
Product Description
Catalog Number:
AG018PWK
Chemical Name:
Boc-(S)-alpha-(4-thiazolylmethyl)-proline
CAS Number:
1217628-22-2
Molecular Formula:
C14H20N2O4S
Molecular Weight:
312.3846
MDL Number:
MFCD06659366
IUPAC Name:
(2S)-1-[(2-methylpropan-2-yl)oxycarbonyl]-2-(1,3-thiazol-4-ylmethyl)pyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C14H20N2O4S/c1-13(2,3)20-12(19)16-6-4-5-14(16,11(17)18)7-10-8-21-9-15-10/h8-9H,4-7H2,1-3H3,(H,17,18)/t14-/m0/s1
InChI Key:
DNMGYWKAZJXMSV-AWEZNQCLSA-N
SMILES:
O=C(N1CCC[C@]1(Cc1ncsc1)C(=O)O)OC(C)(C)C
Properties
Complexity:
424
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
312.114g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
312.384g/mol
Monoisotopic Mass:
312.114g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.