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210539-03-0 | 1,6-Naphthyridin-2(1H)-one, 3,4,5,6,7,8-hexahydro-6-(phenylmethyl)-
CAS No: 210539-03-0 Catalog No: AG002KUL MDL No:MFCD09403131
Product Description
Catalog Number:
AG002KUL
Chemical Name:
1,6-Naphthyridin-2(1H)-one, 3,4,5,6,7,8-hexahydro-6-(phenylmethyl)-
CAS Number:
210539-03-0
Molecular Formula:
C15H18N2O
Molecular Weight:
242.3162
MDL Number:
MFCD09403131
IUPAC Name:
6-benzyl-1,3,4,5,7,8-hexahydro-1,6-naphthyridin-2-one
InChI:
InChI=1S/C15H18N2O/c18-15-7-6-13-11-17(9-8-14(13)16-15)10-12-4-2-1-3-5-12/h1-5H,6-11H2,(H,16,18)
InChI Key:
SZWKETFREPZUDD-UHFFFAOYSA-N
SMILES:
O=C1CCC2=C(N1)CCN(C2)Cc1ccccc1
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.142g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
242.322g/mol
Monoisotopic Mass:
242.142g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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