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Home > Pyridines > 692889-71-7
692889-71-7 | tert-butyl N-[2-(pyridin-4-yl)-1,3-thiazol-4-yl]carbamate
CAS No: 692889-71-7 Catalog No: AG01A6VR MDL No:MFCD24467297
Product Description
Catalog Number:
AG01A6VR
Chemical Name:
tert-butyl N-[2-(pyridin-4-yl)-1,3-thiazol-4-yl]carbamate
CAS Number:
692889-71-7
Molecular Formula:
C13H15N3O2S
Molecular Weight:
277.3421
MDL Number:
MFCD24467297
IUPAC Name:
tert-butyl N-(2-pyridin-4-yl-1,3-thiazol-4-yl)carbamate
InChI:
InChI=1S/C13H15N3O2S/c1-13(2,3)18-12(17)16-10-8-19-11(15-10)9-4-6-14-7-5-9/h4-8H,1-3H3,(H,16,17)
InChI Key:
SBWCFJQHZQVNBN-UHFFFAOYSA-N
SMILES:
O=C(Nc1csc(n1)c1ccncc1)OC(C)(C)C
Properties
Complexity:
314
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.088g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
277.342g/mol
Monoisotopic Mass:
277.088g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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