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1333833-69-4 | 4-phenyl-5-(propan-2-yl)-2-(pyrrolidin-2-yl)-1,3-oxazole hydrochloride
CAS No: 1333833-69-4 Catalog No: AG01AJZZ MDL No:MFCD19982386
Product Description
Catalog Number:
AG01AJZZ
Chemical Name:
4-phenyl-5-(propan-2-yl)-2-(pyrrolidin-2-yl)-1,3-oxazole hydrochloride
CAS Number:
1333833-69-4
Molecular Formula:
C16H21ClN2O
Molecular Weight:
292.8037
MDL Number:
MFCD19982386
IUPAC Name:
4-phenyl-5-propan-2-yl-2-pyrrolidin-2-yl-1,3-oxazole;hydrochloride
InChI:
InChI=1S/C16H20N2O.ClH/c1-11(2)15-14(12-7-4-3-5-8-12)18-16(19-15)13-9-6-10-17-13;/h3-5,7-8,11,13,17H,6,9-10H2,1-2H3;1H
InChI Key:
RAXNOXHONSKVIP-UHFFFAOYSA-N
SMILES:
CC(c1oc(nc1c1ccccc1)C1CCCN1)C.Cl
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.134g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
292.807g/mol
Monoisotopic Mass:
292.134g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
38.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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