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1785762-76-6 | 2-[5-(3-methoxybenzyl)-1,3-oxazol-2-yl]piperidine hydrochloride
CAS No: 1785762-76-6 Catalog No: AG00J64U MDL No:MFCD27756604
Product Description
Catalog Number:
AG00J64U
Chemical Name:
2-[5-(3-methoxybenzyl)-1,3-oxazol-2-yl]piperidine hydrochloride
CAS Number:
1785762-76-6
Molecular Formula:
C16H20N2O2
Molecular Weight:
272.3422
MDL Number:
MFCD27756604
IUPAC Name:
5-[(3-methoxyphenyl)methyl]-2-piperidin-2-yl-1,3-oxazole
InChI:
InChI=1S/C16H20N2O2/c1-19-13-6-4-5-12(9-13)10-14-11-18-16(20-14)15-7-2-3-8-17-15/h4-6,9,11,15,17H,2-3,7-8,10H2,1H3
InChI Key:
WCGSUMAQJPCBNY-UHFFFAOYSA-N
SMILES:
COc1cccc(c1)Cc1cnc(o1)C1CCCCN1
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.152g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
272.348g/mol
Monoisotopic Mass:
272.152g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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