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Substance Name: 2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(2-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-1-piperazinyl)propyl)-, hydrochloride, hydrate (2:4:3)
RN: 121943-03-1
InChIKey: LXIHFJYOGKQDIV-UHFFFAOYSA-N
Classification Code
- Drug / Therapeutic Agent
Molecular Formula
- C28-H29-Cl-N4-O-S.2Cl-H.3/2H2-O
Molecular Weight
- 578.0049
Names and Synonyms
- 2H-Benzimidazol-2-one, 1,3-dihydro-1-(3-(4-(2-chloro-10,11-dihydrodibenzo(b,f)thiepin-10-yl)-1-piperazinyl)propyl)-, hydrochloride, hydrate (2:4:3)
Registry Numbers
CAS Registry Number
- 121943-03-1
System Generated Number
- 0121943031
Molecular Formulas
Molecular Formula
- C28-H29-Cl-N4-O-S.2Cl-H.3/2H2-O
Molecular Formula Fragments
- C28-H29-Cl-N4-O-S
- Cl-H
- COMPONENT
- H2-O
Structure Descriptors
InChI
1S/C28H29ClN4OS.2ClH/c29-21-10-11-26-20(18-21)19-25(22-6-1-4-9-27(22)35-26)32-16-14-31(15-17-32)12-5-13-33-24-8-3-2-7-23(24)30-28(33)34;;/h1-4,6-11,18,25H,5,12-17,19H2,(H,30,34);2*1HInChIKey
LXIHFJYOGKQDIV-UHFFFAOYSA-NSmiles
c1ccc2c(c1)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | oral | 800mg/kg (800mg/kg) | Collection of Czechoslovak Chemical Communications. Vol. 53, Pg. 870, 1988. |