Home Carboxys 3-Thiophenecarboxylic acid, 2-amino-4-[1,1'-biphenyl]-4-yl-, ethyl ester

3-Thiophenecarboxylic acid, 2-amino-4-[1,1'-biphenyl]-4-yl-, ethyl ester

CAS No.:
307343-50-6
Catalog Number:
AG00313J
Molecular Formula:
C19H17NO2S
Molecular Weight:
323.4088
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Product Description
Catalog Number:
AG00313J
Chemical Name:
3-Thiophenecarboxylic acid, 2-amino-4-[1,1'-biphenyl]-4-yl-, ethyl ester
CAS Number:
307343-50-6
Molecular Formula:
C19H17NO2S
Molecular Weight:
323.4088
MDL Number:
MFCD01912029
IUPAC Name:
ethyl 2-amino-4-(4-phenylphenyl)thiophene-3-carboxylate
InChI:
InChI=1S/C19H17NO2S/c1-2-22-19(21)17-16(12-23-18(17)20)15-10-8-14(9-11-15)13-6-4-3-5-7-13/h3-12H,2,20H2,1H3
InChI Key:
GGRXYEXAHRYAIO-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1c(N)scc1c1ccc(cc1)c1ccccc1
Properties
Complexity:
389  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.098g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
323.41g/mol
Monoisotopic Mass:
323.098g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3  
Properties