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74641-51-3 | Pyridine, 3-[2,5-dihydro-2,2,5-trimethyl-4-(2-thienyl)-5-oxazolyl]-
CAS No: 74641-51-3 Catalog No: AG005AEG MDL No:
Product Description
Catalog Number:
AG005AEG
Chemical Name:
Pyridine, 3-[2,5-dihydro-2,2,5-trimethyl-4-(2-thienyl)-5-oxazolyl]-
CAS Number:
74641-51-3
Molecular Formula:
C15H16N2OS
Molecular Weight:
272.3653
IUPAC Name:
2,2,5-trimethyl-5-pyridin-3-yl-4-thiophen-2-yl-1,3-oxazole
InChI:
InChI=1S/C15H16N2OS/c1-14(2)17-13(12-7-5-9-19-12)15(3,18-14)11-6-4-8-16-10-11/h4-10H,1-3H3
InChI Key:
XPOPYQFJDLZJNN-UHFFFAOYSA-N
SMILES:
CC1(C)N=C(C(O1)(C)c1cccnc1)c1cccs1
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.098g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.366g/mol
Monoisotopic Mass:
272.098g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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