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Home > Other Heterocycles > 17783-46-9
17783-46-9 | 3,8-Diazabicyclo[3.2.1]octane-2,4-dione, 8-methyl-3-(phenylmethyl)-
CAS No: 17783-46-9 Catalog No: AG0025L8 MDL No:MFCD08693836
Product Description
Catalog Number:
AG0025L8
Chemical Name:
3,8-Diazabicyclo[3.2.1]octane-2,4-dione, 8-methyl-3-(phenylmethyl)-
CAS Number:
17783-46-9
Molecular Formula:
C14H16N2O2
Molecular Weight:
244.2890
MDL Number:
MFCD08693836
IUPAC Name:
3-benzyl-8-methyl-3,8-diazabicyclo[3.2.1]octane-2,4-dione
InChI:
InChI=1S/C14H16N2O2/c1-15-11-7-8-12(15)14(18)16(13(11)17)9-10-5-3-2-4-6-10/h2-6,11-12H,7-9H2,1H3
InChI Key:
LAEFEQWBXJQNGP-UHFFFAOYSA-N
SMILES:
CN1C2CCC1C(=O)N(C2=O)Cc1ccccc1
NSC Number:
145984
Properties
Complexity:
339
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.121g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.294g/mol
Monoisotopic Mass:
244.121g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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