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Substance Name: Clorexolone [USAN:INN:BAN]
RN: 2127-01-7
UNII: Q2PLT3FS05
InChIKey: VPMWFZKOWULPGT-UHFFFAOYSA-N
Classification Codes
- Diuretic
- Drug / Therapeutic Agent
Molecular Formula
- C14-H17-Cl-N2-O3-S
Molecular Weight
- 328.8183
- All
- Links to Resources
- Names & Synonyms
- Registry Numbers
- Structure Descriptors
- Toxicity
- Physical Properties
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Names and Synonyms
Name of Substance
- Clorexolone
- Clorexolone [USAN:INN:BAN]
Synonyms
- 12833 R.P.
- 1H-Isoindole-5-sulfonamide, 2,3-dihydro-6-chloro-2-cyclohexyl-3-oxo-
- 5-22-07-00591 (Beilstein Handbook Reference)
- 5-Chloro-2-cyclohexyl-1-oxo-6-sulphamoylisoindoline
- 6-Chloro-2-cyclohexyl-3-oxo-5-isoindolinesulfonamide
- BRN 0493411
- Chlorexolone
- Cloresolone
- Cloresolone [DCIT]
- Clorexolon
- Clorexolona
- Clorexolona [INN-Spanish]
- Clorexolone
- Clorexolonum
- Clorexolonum [INN-Latin]
- EINECS 218-342-6
- Flonatril
- Klorex
- M & B 8430
- Nefrolan
- RP 12833
- UNII-Q2PLT3FS05
Systematic Names
- 1H-Isoindole-5-sulfonamide, 6-chloro-2-cyclohexyl-2,3-dihydro-3-oxo-
- 5-Isoindolinesulfonamide, 6-chloro-2-cyclohexyl-3-oxo-
- 6-Chloro-2-cyclohexyl-2,3-dihydro-3-oxo-1H-isoindole-5-sulfonamide
- Clorexolone
Registry Numbers
CAS Registry Number
- 2127-01-7
FDA UNII
- Q2PLT3FS05
System Generated Number
- 0002127017
Structure Descriptors
InChI
InChI=1S/C14H17ClN2O3S/c15-12-6-9-8-17(10-4-2-1-3-5-10)14(18)11(9)7-13(12)21(16,19)20/h6-7,10H,1-5,8H2,(H2,16,19,20)InChIKey
VPMWFZKOWULPGT-UHFFFAOYSA-NSmiles
NS(=O)Toxicity
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | intraperitoneal | 560mg/kg (560mg/kg) | BEHAVIORAL: ATAXIA KIDNEY, URETER, AND BLADDER: URINE VOLUME INCREASED LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION | Bulletin of the Faculty of Pharmacy Vol. 10, Pg. 155, 1971. |
| mouse | LD50 | intravenous | 230mg/kg (230mg/kg) | LUNGS, THORAX, OR RESPIRATION: DYSPNEA BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD | Journal of Pharmacy and Pharmacology. Vol. 18, Pg. 65, 1966. |
| mouse | LD50 | oral | > 6gm/kg (6000mg/kg) | Drugs in Japan Vol. 6, Pg. 257, 1982. | |
| rat | LD50 | intravenous | 120mg/kg (120mg/kg) | LUNGS, THORAX, OR RESPIRATION: DYSPNEA BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD | Journal of Pharmacy and Pharmacology. Vol. 18, Pg. 65, 1966. |
| rat | LD50 | oral | 6gm/kg (6000mg/kg) | Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 21, Pg. 775, 1979. |
Physical Properties
| Physical Property | Value | Units | Temp (deg C) | Source |
|---|---|---|---|---|
| Melting Point | 267 | deg C | EXP | |
| log P (octanol-water) | 1.960 | (none) | EST | |
| Water Solubility | 16 | mg/L | 25 | EXP |
| Atmospheric OH Rate Constant | 3.72E-11 | cm3/molecule-sec | 25 | EST |
Physical property data is provided to ChemIDplus by SRC, Inc.