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15026-37-6

15026-37-6 | 14-Azadispiro[5.1.5.2]pentadec-9-en-15-one, 7,14-dihydroxy-7-phenyl-

CAS No: 15026-37-6 Catalog No: AG001MG9 MDL No:

Product Description

Catalog Number:
AG001MG9
Chemical Name:
14-Azadispiro[5.1.5.2]pentadec-9-en-15-one, 7,14-dihydroxy-7-phenyl-
CAS Number:
15026-37-6
Molecular Formula:
C20H25NO3
Molecular Weight:
327.4174
IUPAC Name:
7,14-dihydroxy-7-phenyl-14-azadispiro[5.1.58.26]pentadec-9-en-15-one
InChI:
InChI=1S/C20H25NO3/c22-17-18(12-6-2-7-13-18)20(23,16-10-4-1-5-11-16)19(21(17)24)14-8-3-9-15-19/h1,4-5,8,10-11,14,23-24H,2-3,6-7,9,12-13,15H2
InChI Key:
RDSYOOCFUMFMDQ-UHFFFAOYSA-N
SMILES:
ON1C(=O)C2(C(C31CCCC=C3)(O)c1ccccc1)CCCCC2
NSC Number:
137350

Properties

Complexity:
533  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.183g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
327.424g/mol
Monoisotopic Mass:
327.183g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
60.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  

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