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Home > Thiazole > 1965304-94-2
1965304-94-2 | 2-(4-n-Butylbiphenyl-4'-yl)-4-(2-hydroxyphenyl)thiazole
CAS No: 1965304-94-2 Catalog No: AG01F7TD MDL No:MFCD28166224
Product Description
Catalog Number:
AG01F7TD
Chemical Name:
2-(4-n-Butylbiphenyl-4'-yl)-4-(2-hydroxyphenyl)thiazole
CAS Number:
1965304-94-2
Molecular Formula:
C25H23NOS
Molecular Weight:
385.5212
MDL Number:
MFCD28166224
IUPAC Name:
2-[2-[4-(4-butylphenyl)phenyl]-1,3-thiazol-4-yl]phenol
InChI:
InChI=1S/C25H23NOS/c1-2-3-6-18-9-11-19(12-10-18)20-13-15-21(16-14-20)25-26-23(17-28-25)22-7-4-5-8-24(22)27/h4-5,7-17,27H,2-3,6H2,1H3
InChI Key:
MUEMCIAKEVGOCG-UHFFFAOYSA-N
SMILES:
CCCCc1ccc(cc1)c1ccc(cc1)c1scc(n1)c1ccccc1O
Properties
Complexity:
456
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
385.15g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
385.525g/mol
Monoisotopic Mass:
385.15g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.4
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