N-TOSYL-(S)-ARGININE METHYL ESTER HYDROCHLORIDE | SBID = 2175 | Compound | Custom Molecule

Struc Structure

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Molecular Properties

Interactions: 2
PubChem TPSA/Å2:
Ertl TPSA/Å2: 134.37
Hydrophilicity (PubChem XLogP):
Hydrophilicity (Cheng XLogP3): 1.55
Charge: 0.0
Number of H-Bond Donors: 0.0
Number of H-Bond Acceptors: 0.0
Number of Stereogenic Bonds (E/Z):
Number of Stereogenic Atoms (R/S):
3D Volume/Å3:
Sum Formula: C14H23ClN4O4S
M / g/mol: 378.87482
Complexity:
Number of Conformers:

Identifiers

  • Tags:
  • Name: N-TOSYL-(S)-ARGININE METHYL ESTER HYDROCHLORIDE
  • Preferred Abbreviation: Tos-Arg-OMe
  • IUPAC Name:
  • CAS:
  • CID: -960
  • InChiKey: JIQFFACVQXXHMY-UHFFFAOYSA-N
  • InChi: InChI=1S/C14H22N4O4S.ClH/c1-10-5-7-11(8-6-10)23(20,21)18-12(13(19)22-2)4-3-9-17-14(15)16;/h5-8,12,18H,3-4,9H2,1-2H3,(H4,15,16,17);1H
  • CanoSmiles: COC(=O)[C@@H](NS(=O)(=O)c1ccc(cc1)C)CCCNC(=N)N.Cl
  • IsoSmiles: N=C(N)NCCC[C@@H](C(OC)=O)NS(=O)(C1=CC=C(C)C=C1)=O.[H]Cl