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Substance Name: Morpholine, 4-(9-(4-(2-chlorophenyl)-9-cyclopropyl-6H-thieno(3,2-f)(1,2,4)triazolo(4,3-a)(1,4)diazepin-2-yl)-1-oxononyl)-
RN: 105241-80-3
InChIKey: SGTLMPUYTVPUOZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C30-H36-Cl-N5-O2-S

Molecular Weight

  • 566.1664
 
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Names and Synonyms

  • Morpholine, 4-(9-(4-(2-chlorophenyl)-9-cyclopropyl-6H-thieno(3,2-f)(1,2,4)triazolo(4,3-a)(1,4)diazepin-2-yl)-1-oxononyl)-

Registry Numbers

CAS Registry Number

  • 105241-80-3

System Generated Number

  • 0105241803

Structure Descriptors

InChI

1S/C30H36ClN5O2S/c31-25-11-8-7-10-23(25)28-24-19-22(39-30(24)36-26(20-32-28)33-34-29(36)21-13-14-21)9-5-3-1-2-4-6-12-27(37)35-15-17-38-18-16-35/h7-8,10-11,19,21H,1-6,9,12-18,20H2

InChIKey

SGTLMPUYTVPUOZ-UHFFFAOYSA-N

Smiles

c1ccc(c(c1)C2=NCc3nnc(n3-c4c2cc(s4)CCCCCCCCC(=O)N5CCOCC5)C6CC6)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 400mg/kg (400mg/kg)   United States Patent Document. Vol. #4968794,
mouse LD50 oral 3gm/kg (3000mg/kg)   United States Patent Document. Vol. #4968794,