Chemical Compound

Tirofiban hydrochloride monohydrate

CAS Registry Number150915-40-5
Tirofiban hydrochloride monohydrate chemical structure
Primary record

Tirofiban hydrochloride monohydrate

CAS
150915-40-5
PubChem CID
60946
SMILES
CCCCS(=O)(=O)N[C@@H](CC1=CC=C(C=C1)OCCCCC2CCNCC2)C(=O)O.O.Cl
Molecular Formula
C22H39ClN2O6S
Molecular Weight
495.082
Exact Mass
494.2217
InChI
InChI=1S/C22H36N2O5S.ClH.H2O/c1-2-3-16-30(27,28)24-21(22(25)26)17-19-7-9-20(10-8-19)29-15-5-4-6-18-11-13-23-14-12-18;;/h7-10,18,21,23-24H,2-6,11-17H2,1H3,(H,25,26);1H;1H2/t21-;;/m0../s1
InChIKey
HWAAPJPFZPHHBC-FGJQBABTSA-N
LogP
2.5476
TPSA
136.23

Names and synonyms

  • Tirofiban hydrochloride monohydrate
  • Tirofiban HCl
  • Aggrastat
  • TIROFIBAN HYDROCHLORIDE
  • 150915-40-5
  • Tirofiban hydrochloride hydrate
  • Tirofiban HCl hydrate
  • Aggrastat (TN)
  • Tirofiban HCl monohydrate
  • C22H39ClN2O6S
  • MK-383 Hydrochloride
  • Tirofiban, Hydrochloride
  • Tirofiban (hydrochloride monohydrate)
  • AC1Q3ETQ
  • Tirofiban hydrochloride [USAN]
  • UNII-IKE1P4X57J
  • UNII-6H925F8O5J
  • AC1L1U7L
  • SCHEMBL41325
  • C22H36N2O5S.ClH
  • DTXSID5048635
  • Tirofiban hydrochloride anhydrous
  • MK-383
  • 6H925F8O5J
  • CHEBI:9606
  • orb1305344
  • Tirofiban hydrochloride (USAN)
  • CHEMBL3189072
  • DTXCID2028561
  • Tirofiban, Hydrochloride Hydrate