Home Other Building Blocks N-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-N-methylformamide

N-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-N-methylformamide

CAS No.:
1909316-26-2
Catalog Number:
AG01C2BV
Molecular Formula:
C12H9N3OS
Molecular Weight:
243.2844
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Product Description
Catalog Number:
AG01C2BV
Chemical Name:
N-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-N-methylformamide
CAS Number:
1909316-26-2
Molecular Formula:
C12H9N3OS
Molecular Weight:
243.2844
MDL Number:
MFCD29047640
IUPAC Name:
N-[4-(4-cyanophenyl)-1,3-thiazol-2-yl]-N-methylformamide
InChI:
InChI=1S/C12H9N3OS/c1-15(8-16)12-14-11(7-17-12)10-4-2-9(6-13)3-5-10/h2-5,7-8H,1H3
InChI Key:
CPGXCOHEQRHTAR-UHFFFAOYSA-N
SMILES:
O=CN(c1scc(n1)c1ccc(cc1)C#N)C
Properties
Complexity:
319  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.047g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.284g/mol
Monoisotopic Mass:
243.047g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
85.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties