Cas no 800-22-6 (Chloracyzine)

Chloracyzine structure
Chloracyzine structure
Product Name:Chloracyzine
CAS No:800-22-6
MF:C19H21ClN2OS
MW:360.900842428207
CID:861801
PubChem ID:13113
Update Time:2025-04-19

Chloracyzine Chemical and Physical Properties

Names and Identifiers

    • Chloracyzine
    • 1-(2-chlorophenothiazin-10-yl)-3-(diethylamino)propan-1-one
    • Chloracizin
    • Chloracizine
    • Chloracizinum
    • Chlorazicin
    • Chlorazicine
    • Chloroacizin
    • Chloroacizine
    • Chloroacyzin
    • 2-Chloro-10-(3-diethylaminopropionyl)phenothiazine
    • BRN 0042353
    • DTXSID6046183
    • 1-(2-Chloro-10H-phenothiazin-10-yl)-3-(diethylamino)-1-propanone
    • Tox21_111848
    • ZZKWNLZUYAGVOT-UHFFFAOYSA-N
    • CAS-800-22-6
    • CHLORACIZINE [MI]
    • Cloracizina [INN-Spanish]
    • Chloracyzine [INN:DCF]
    • UNII-TZ913SWN6M
    • MLS006011648
    • NCGC00160486-01
    • 800-22-6
    • Cloracizina
    • 2-Chloro-10-(N,N-diethyl-beta-alanyl)phenothiazine
    • G-020
    • SMR004703406
    • Phenothiazine, 2-chloro-10-(N,N-diethyl-.beta.-alanyl)-
    • BDBM50408496
    • Phenothiazine, 2-chloro-10-(N,N-diethyl-beta-alanyl)-
    • Chloracyzinum [INN-Latin]
    • DTXCID4026183
    • BRD-K99124663-001-01-1
    • 2-Chloro-10-(N,N-diethyl-.beta.-alanyl)phenothiazine
    • CHLORACYZINE [INN]
    • Khloratsizin
    • SCHEMBL309939
    • 10H-Phenothiazine, 2-chloro-10-(3-(diethylamino)-1-oxopropyl)-
    • CHEMBL290624
    • AKOS001491164
    • AB00918350-05
    • Chloracysin
    • Chloracyzinum
    • TZ913SWN6M
    • Q27290492
    • Chlorocizin
    • Oprea1_047986
    • Inchi: 1S/C19H21ClN2OS/c1-3-21(4-2)12-11-19(23)22-15-7-5-6-8-17(15)24-18-10-9-14(20)13-16(18)22/h5-10,13H,3-4,11-12H2,1-2H3
    • InChI Key: ZZKWNLZUYAGVOT-UHFFFAOYSA-N
    • SMILES: ClC1C=CC2=C(C=1)N(C1C=CC=CC=1S2)C(CCN(CC)CC)=O

Computed Properties

  • Exact Mass: 360.10600
  • Monoisotopic Mass: 360.106312
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 5
  • Complexity: 432
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.8
  • Topological Polar Surface Area: 48.8

Experimental Properties

  • Density: 1.246
  • Boiling Point: 553.9°C at 760 mmHg
  • Flash Point: 288.8°C
  • Refractive Index: 1.621
  • PSA: 48.85000
  • LogP: 5.26620
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