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Home > Sulfanilamide > 627534-43-4
627534-43-4 | (S)-N-(2-HYDROXY-2-METHYL-1-PHENYL-PROPYL)-4-METHYL-BENZENESULFONAMIDE
CAS No: 627534-43-4 Catalog No: AG00EAPZ MDL No:MFCD09025334
Product Description
Catalog Number:
AG00EAPZ
Chemical Name:
(S)-N-(2-HYDROXY-2-METHYL-1-PHENYL-PROPYL)-4-METHYL-BENZENESULFONAMIDE
CAS Number:
627534-43-4
Molecular Formula:
C17H21NO3S
Molecular Weight:
319.4185
MDL Number:
MFCD09025334
IUPAC Name:
N-[(1S)-2-hydroxy-2-methyl-1-phenylpropyl]-4-methylbenzenesulfonamide
InChI:
InChI=1S/C17H21NO3S/c1-13-9-11-15(12-10-13)22(20,21)18-16(17(2,3)19)14-7-5-4-6-8-14/h4-12,16,18-19H,1-3H3/t16-/m0/s1
InChI Key:
ZTVQXNICBNVQJO-INIZCTEOSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)N[C@H](C(O)(C)C)c1ccccc1
Properties
Complexity:
441
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
319.124g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
319.419g/mol
Monoisotopic Mass:
319.124g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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