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1414661-50-9 | 2-(Fmoc-amino)-5-methyl-4-phenylthiazole
CAS No: 1414661-50-9 Catalog No: AG01FC08 MDL No:MFCD22581242
Product Description
Catalog Number:
AG01FC08
Chemical Name:
2-(Fmoc-amino)-5-methyl-4-phenylthiazole
CAS Number:
1414661-50-9
Molecular Formula:
C25H20N2O2S
Molecular Weight:
412.5035
MDL Number:
MFCD22581242
IUPAC Name:
9H-fluoren-9-ylmethyl N-(5-methyl-4-phenyl-1,3-thiazol-2-yl)carbamate
InChI:
InChI=1S/C25H20N2O2S/c1-16-23(17-9-3-2-4-10-17)26-24(30-16)27-25(28)29-15-22-20-13-7-5-11-18(20)19-12-6-8-14-21(19)22/h2-14,22H,15H2,1H3,(H,26,27,28)
InChI Key:
SCUAHDHRGREECJ-UHFFFAOYSA-N
SMILES:
O=C(Nc1sc(c(n1)c1ccccc1)C)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
574
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
412.125g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
412.507g/mol
Monoisotopic Mass:
412.125g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
79.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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