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89820-04-2 | N-(OXIRAN-2-YLMETHYL)-N-(2-PHENYLPROPAN-2-YL)BENZENESULFONAMIDE
CAS No: 89820-04-2 Catalog No: AG0086JN MDL No:
Product Description
Catalog Number:
AG0086JN
Chemical Name:
N-(OXIRAN-2-YLMETHYL)-N-(2-PHENYLPROPAN-2-YL)BENZENESULFONAMIDE
CAS Number:
89820-04-2
Molecular Formula:
C18H21NO3S
Molecular Weight:
331.4292
IUPAC Name:
N-(oxiran-2-ylmethyl)-N-(2-phenylpropan-2-yl)benzenesulfonamide
InChI:
InChI=1S/C18H21NO3S/c1-18(2,15-9-5-3-6-10-15)19(13-16-14-22-16)23(20,21)17-11-7-4-8-12-17/h3-12,16H,13-14H2,1-2H3
InChI Key:
YHQUZEUDZJBJPL-UHFFFAOYSA-N
SMILES:
CC(N(S(=O)(=O)c1ccccc1)CC1OC1)(c1ccccc1)C
Properties
Complexity:
485
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.124g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
331.43g/mol
Monoisotopic Mass:
331.124g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
58.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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