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Home > Other Heterocycles > 37603-06-8
37603-06-8 | 8-((5-methoxy-2,3-dihydrobenzofuran-2-yl)methyl)-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
CAS No: 37603-06-8 Catalog No: AG01DG5O MDL No:
Product Description
Catalog Number:
AG01DG5O
Chemical Name:
8-((5-methoxy-2,3-dihydrobenzofuran-2-yl)methyl)-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
CAS Number:
37603-06-8
Molecular Formula:
C23H27N3O3
Molecular Weight:
393.4788
IUPAC Name:
8-[(5-methoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
InChI:
InChI=1S/C23H27N3O3/c1-28-19-7-8-21-17(13-19)14-20(29-21)15-25-11-9-23(10-12-25)22(27)24-16-26(23)18-5-3-2-4-6-18/h2-8,13,20H,9-12,14-16H2,1H3,(H,24,27)
InChI Key:
QSTYMRMEJNQSJW-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)CC(O2)CN1CCC2(CC1)C(=O)NCN2c1ccccc1
NSC Number:
297106
Properties
Complexity:
586
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
393.205g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
393.487g/mol
Monoisotopic Mass:
393.205g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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