Home Carboxys ethyl 2-(4-(tert-butoxycarbonylamino)phenyl)thiazole-4-carboxylate

ethyl 2-(4-(tert-butoxycarbonylamino)phenyl)thiazole-4-carboxylate

CAS No.:
494854-19-2
Catalog Number:
AG00DKB1
Molecular Formula:
C17H20N2O4S
Molecular Weight:
348.4167
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Product Description
Catalog Number:
AG00DKB1
Chemical Name:
ethyl 2-(4-(tert-butoxycarbonylamino)phenyl)thiazole-4-carboxylate
CAS Number:
494854-19-2
Molecular Formula:
C17H20N2O4S
Molecular Weight:
348.4167
MDL Number:
MFCD17779283
IUPAC Name:
ethyl 2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]-1,3-thiazole-4-carboxylate
InChI:
InChI=1S/C17H20N2O4S/c1-5-22-15(20)13-10-24-14(19-13)11-6-8-12(9-7-11)18-16(21)23-17(2,3)4/h6-10H,5H2,1-4H3,(H,18,21)
InChI Key:
GRHIIEZROYYMPD-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1csc(n1)c1ccc(cc1)NC(=O)OC(C)(C)C
Properties
Complexity:
444  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
348.114g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
348.417g/mol
Monoisotopic Mass:
348.114g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties