(S)-N-[2-[(3-Hydroxypropyl)amino]-1-methylethyl]-4-methyl-benzenesulfonamide - CAS 194032-20-7
Catalog: |
BB064057 |
Product Name: |
(S)-N-[2-[(3-Hydroxypropyl)amino]-1-methylethyl]-4-methyl-benzenesulfonamide |
CAS: |
194032-20-7 |
Synonyms: |
N-[(2S)-1-(3-hydroxypropylamino)propan-2-yl]-4-methylbenzenesulfonamide; N-{(2S)-1-[(3-Hydroxypropyl)amino]propan-2-yl}-4-methylbenzene-1-sulfonamide; (S)-N-[2-[(3-Hydroxypropyl)amino]-1-methylethyl]-4-methyl-benzenesulfonamide |
IUPAC Name: | N-[(2S)-1-(3-hydroxypropylamino)propan-2-yl]-4-methylbenzenesulfonamide |
Description: | (S)-N-[2-[(3-Hydroxypropyl)amino]-1-methylethyl]-4-methyl-benzenesulfonamide (cas# 194032-20-7) is a compound useful in organic synthesis. |
Molecular Weight: | 286.39 |
Molecular Formula: | C13H22N2O3S |
Canonical SMILES: | CC1=CC=C(C=C1)S(=O)(=O)NC(C)CNCCCO |
InChI: | InChI=1S/C13H22N2O3S/c1-11-4-6-13(7-5-11)19(17,18)15-12(2)10-14-8-3-9-16/h4-7,12,14-16H,3,8-10H2,1-2H3/t12-/m0/s1 |
InChI Key: | MPAJBNPHILJRRI-LBPRGKRZSA-N |
Appearance: | Yellow Solid |
Complexity: | 332 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 286.13511374 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 286.13511374 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 86.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.9 |
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