HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 985472Erstellt: 4. November 2026
2-[({6-[(1H-Benzimidazol-2-ylsulfanyl)methyl]-2-pyridinyl}methyl)sulfanyl]-1H-benzimidazole
https://huagongshe.com/de/chemical/985472
Identifikatoren & physikalische Daten
| CAS No. | 123771-22-2 |
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| Summenformel | C21H17N5S2 |
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| Durchschnittliche Molmasse | 403,5 g/mol |
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| Monoisotopische Masse | 403,09253791 g/mol |
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| SMILES | c1cc(CSc2nc3ccccc3[nH]2)nc(CSc2nc3ccccc3[nH]2)c1 |
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| InChIKey | TYMDRIURLRAWCF-UHFFFAOYSA-N |
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| PubChem CID | 985472 |
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| ChEMBL | CHEMBL1084821 |
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| EC No. | 167-633-3 |
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Chemische & physikalische Eigenschaften
| XLogP | 4,7 |
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| Polarare Oberfläche (TPSA) | 121 |
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| H-Brücken-Donoren | 2 |
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| H-Brücken-Akzeptoren | 5 |
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| Frei drehbare Bindungen | 6 |
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| Schwere Atome | 28 |
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| Formalladung | 0 |
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| Komplexität | 467 |
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Sicherheit & Vorschriften
| GHS-Einstufung | WarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
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| Hazard Classes and Categories | Skin Irrit. 2 (100%) |
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![Molekülstruktur von 2-[({6-[(1H-Benzimidazol-2-ylsulfanyl)methyl]-2-pyridinyl}methyl)sulfanyl]-1H-benzimidazole](/img/chemical/985472.png)