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Substance Name: Benzoxazole, 5-chloro-2-(3-(dimethylamino)propyl)amino-
RN: 64037-21-4
InChIKey: UPXNTQIUGPERQJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H16-Cl-N3-O

Molecular Weight

  • 253.731
 
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Names and Synonyms

Synonyms

  • 5-Chloro-2-(3-(dimethylamino)propyl)aminobenzoxazole
  • BRN 1076863

Systematic Name

  • Benzoxazole, 5-chloro-2-(3-(dimethylamino)propyl)amino-

Registry Numbers

CAS Registry Number

  • 64037-21-4

System Generated Number

  • 0064037214

Structure Descriptors

InChI

1S/C12H16ClN3O/c1-16(2)7-3-6-14-12-15-10-8-9(13)4-5-11(10)17-12/h4-5,8H,3,6-7H2,1-2H3,(H,14,15)

InChIKey

UPXNTQIUGPERQJ-UHFFFAOYSA-N

Smiles

c12c(oc(n1)NCCCN(C)C)ccc(c2)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 230mg/kg (230mg/kg)   Medicinal Chemistry: A Series of Monographs. Vol. 4(1), Pg. 337, 1964.
mouse LD50 oral 1gm/kg (1000mg/kg)   Medicinal Chemistry: A Series of Monographs. Vol. 4(1), Pg. 337, 1964.
rat LD50 oral > 1gm/kg (1000mg/kg)   Medicinal Chemistry: A Series of Monographs. Vol. 4(1), Pg. 338, 1964.