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192318-05-1 | Pyridine, 2-[(4S)-4-(cyclohexylmethyl)-4,5-dihydro-2-oxazolyl]-
CAS No: 192318-05-1 Catalog No: AG002FU2 MDL No:
Product Description
Catalog Number:
AG002FU2
Chemical Name:
Pyridine, 2-[(4S)-4-(cyclohexylmethyl)-4,5-dihydro-2-oxazolyl]-
CAS Number:
192318-05-1
Molecular Formula:
C15H20N2O
Molecular Weight:
244.3321
IUPAC Name:
(4S)-4-(cyclohexylmethyl)-2-pyridin-2-yl-4,5-dihydro-1,3-oxazole
InChI:
InChI=1S/C15H20N2O/c1-2-6-12(7-3-1)10-13-11-18-15(17-13)14-8-4-5-9-16-14/h4-5,8-9,12-13H,1-3,6-7,10-11H2/t13-/m0/s1
InChI Key:
YPFYPRJDLNEUGB-ZDUSSCGKSA-N
SMILES:
C1CCC(CC1)C[C@H]1COC(=N1)c1ccccn1
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
244.158g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.338g/mol
Monoisotopic Mass:
244.158g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
34.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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