HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HCID 5353Erstellt: 27. Oktober 2026
Sulmazol
SULMAZOLE · Vardax · ar-l115bs · 5-b)pyridine,2-(2-methoxy-4-(methylsulfinyl)phenyl)-1h-imidazo( · 2-(2-methoxy-4-(methylsulfinyl)phenyl)-3H-imidazo[4,5-b]pyridine · 2-[2-METHOXY-4-(METHYLSULFINYL)PHENYL]-1H-IMIDAZO[4,5-B]PYRIDINE · 3H-Imidazo[4,5-b]pyridine, 2-[2-methoxy-4-(methylsulfinyl)phenyl]-
https://huagongshe.com/de/chemical/5353
Identifikatoren & physikalische Daten
| CAS No. | 73384-60-8 |
|---|
| Summenformel | C14H13N3O2S |
|---|
| Durchschnittliche Molmasse | 287,34 g/mol |
|---|
| Monoisotopische Masse | 287,07284766 g/mol |
|---|
| SMILES | COc1cc(S(C)=O)ccc1-c1nc2ncccc2[nH]1 |
|---|
| InChIKey | XMFCOYRWYYXZMY-UHFFFAOYSA-N |
|---|
| PubChem CID | 5353 |
|---|
| ChEMBL | CHEMBL286020 |
|---|
| ChEBI | CHEBI:34988 |
|---|
| EC No. | 277-406-1 |
|---|
| DTXSID | DTXSID1040617 |
|---|
| Lokaler Name | Sulmazol |
|---|
Chemische & physikalische Eigenschaften
| XLogP | 1,2 |
|---|
| Polarare Oberfläche (TPSA) | 87,1 |
|---|
| H-Brücken-Donoren | 1 |
|---|
| H-Brücken-Akzeptoren | 5 |
|---|
| Frei drehbare Bindungen | 3 |
|---|
| Schwere Atome | 20 |
|---|
| Formalladung | 0 |
|---|
| Komplexität | 368 |
|---|
| Collision Cross Section | 166.4 Ų [M+H]+ [CCS Type: TWMethod: calibrated with polyalanine and drug standards]178.7 Ų [M+Na]+ [CCS Type: TW |
|---|
| Schmelzpunkt | 203-205° |
|---|
| Siedepunkt | 527.3±60.0 °C(Predicted) |
|---|
| Dichte | 1.43±0.1 g/cm3(Predicted) |
|---|
| Lagerbedingungen | 2-8°C |
|---|
| pKa (Säurekonstante) | 6+-.0.20(Predicted) |
|---|
Sicherheit & Vorschriften
| GHS-Einstufung | WarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|
| Hazard Classes and Categories | Acute Tox. 4 (100%) |
|---|
| Wassergefährdungsklasse (WGK) | 3 |
|---|
| RTECS-Nr. | NJ5749500 |
|---|
| R-Sätze (R) | 22-36/37/38 |
|---|
| Toxizität | LD50 in albino mice (mg/kg): 560 orally163 i.v. (Diederen, Kadatz) |
|---|
| Gefahrensymbole | Xn |
|---|
| Sicherheitshinweise (S) | 26-36 |
|---|
