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1255574-36-7 | 1,3,4-Thiadiazol-2-amine, 5-(4'-methyl[1,1'-biphenyl]-4-yl)-
CAS No: 1255574-36-7 Catalog No: AG000NUQ MDL No:MFCD17926504
Product Description
Catalog Number:
AG000NUQ
Chemical Name:
1,3,4-Thiadiazol-2-amine, 5-(4'-methyl[1,1'-biphenyl]-4-yl)-
CAS Number:
1255574-36-7
Molecular Formula:
C15H13N3S
Molecular Weight:
267.3488
MDL Number:
MFCD17926504
IUPAC Name:
5-[4-(4-methylphenyl)phenyl]-1,3,4-thiadiazol-2-amine
InChI:
InChI=1S/C15H13N3S/c1-10-2-4-11(5-3-10)12-6-8-13(9-7-12)14-17-18-15(16)19-14/h2-9H,1H3,(H2,16,18)
InChI Key:
FRSLWDFUGLTQLL-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)c1ccc(cc1)c1nnc(s1)N
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.083g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
267.35g/mol
Monoisotopic Mass:
267.083g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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