Grundinformationen
- Standard-SMILES
CS(=O)(=O)CS(=O)(=O)OCCCl- InChIKey
SEHSPJCWCBQHPF-UHFFFAOYSA-N- Summenformel
- C4H9ClO5S2
- Durchschnittliche Molmasse
- 236,7 g/mol
- Monoisotopische Masse
- 235,95799307
Überblick
Clomesone is the 2-chloroethyl ester of (methylsulfonyl) methanesulfonic acid with potential antineoplastic effects. Acting as a chloroethylating agent, clomesone induces the formation of DNA interstrand crosslinks in some cell lines, and exhibits antitumor activity in some animal models. Alkylating agents exert cytotoxic and, in some cases, chemotherapeutic effects by transferring alkyl groups to DNA, thereby damaging DNA and interfering with DNA synthesis and cell division. (NCI04)
Namen und Bezeichner
- Bevorzugter Name
- 2-Chloroethyl 1-(methylsulfonyl)methanesulfonate
- IUPAC
- 2-chloroethyl methylsulfonylmethanesulfonate
- Englischer Name
- clomesone
- Summenformel
- C4H9ClO5S2
- Molmasse
- 236.695
Namen und Synonyme
Clomesone88343-72-0Chlorethyl SOSO2-Chloroethyl (methylsulfonyl)methanesulfonateSRI 61552J031W0YZINSC338947DTXSID10236979NSC-33847clomesome2-CMSMSRefChem:577733
Weitere Namen anzeigen
SRI-6155Clomesone, 10 mM in DMSOMethanesulfonic acid, 1-(methylsulfonyl)-, 2-chloroethyl ester
2-chloroethyl-(methylsulfonyl)methanesulfonateDTXCID901594702-Chloroethyl 1-(methylsulfonyl)methanesulfonate2-chloroethyl methanesulfonylmethanesulfonate2-chloroethyl methylsulfonylmethanesulfonateNSC 338947NSC-338947(Methylsulfonyl)methanesulfonic acid 2-chloroethyl ester
Datenbank-Bezeichner
- CAS
88343-72-0- PubChem CID
- 100651
- DTXSID
DTXSID10236979- ChEMBL
CHEMBL290487- UNII
- 2J031W0YZI
- Nikkaji
- J78.420F
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- -0,3
- Polarare Oberfläche (TPSA)
- 94,3 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 5
- Frei drehbare Bindungen
- 5
- Schwere Atome
- 12
- Formalladung
- 0
- Komplexität
- 304
Experimentelle und physikochemische Eigenschaften
Solubility
Water 4 (mg/mL)
Acetate buffer, pH 4 6 (mg/mL)
Carbonate buffer, pH 9 6 (mg/mL)
0.1 N HCl 4 (mg/mL)
0.1 N Naoh 15 (mg/mL)
Ethanol (95%) 18 (mg/mL)
Stability/Shelf LifeBulk: Clomesone is stable at room temperature in light or dark conditions but is unstable when stored at 50 °C in both light and dark conditions. Solution: The t90 of an aqueous solution is 207 minutes.
Sicherheit und Regulatorisches
Sicherheitsdaten
- Alarmwort
- Warnung
- Gefahrenhinweise
- Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H302
Chemie und Industrie
Pharmakologische Informationen
MeSH Pharmacological ClassificationSubstances that inhibit or prevent the proliferation of NEOPLASMS.
Anbieter6 Anbieter
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
上海阿摩尔生物科技有限公司13370042665 18916960931 · [email protected]
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