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824390-93-4 | Azetidine, 2-(4-methoxyphenyl)-1-[(4-methylphenyl)sulfonyl]-
CAS No: 824390-93-4 Catalog No: AG00522O MDL No:MFCD25371688
Product Description
Catalog Number:
AG00522O
Chemical Name:
Azetidine, 2-(4-methoxyphenyl)-1-[(4-methylphenyl)sulfonyl]-
CAS Number:
824390-93-4
Molecular Formula:
C17H19NO3S
Molecular Weight:
317.4027
MDL Number:
MFCD25371688
IUPAC Name:
2-(4-methoxyphenyl)-1-(4-methylphenyl)sulfonylazetidine
InChI:
InChI=1S/C17H19NO3S/c1-13-3-9-16(10-4-13)22(19,20)18-12-11-17(18)14-5-7-15(21-2)8-6-14/h3-10,17H,11-12H2,1-2H3
InChI Key:
RFYOLQWRUOYQGJ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C1CCN1S(=O)(=O)c1ccc(cc1)C
Properties
Complexity:
457
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.109g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
317.403g/mol
Monoisotopic Mass:
317.109g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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