Basic information
- CAS
105118-14-7- Standard SMILES
CCN(CC)CC[n+]1ccc2c(C)c3[nH]c4ccc(O)cc4c3c(C)c2c1.[Cl-]- InChIKey
UCICRVXYPSKKJK-UHFFFAOYSA-N- Molecular formula
- C23H28ClN3O
- Average molar mass
- 397.9 g/mol
- Monoisotopic mass
- 397.1920902
Names & identifiers
- Preferred name
- Datelliptium Chloride
- IUPAC
- 2-[2-(diethylamino)ethyl]-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-9-ol chloride
- English name
- Datelliptium
- Molecular weight
- 0
Names & synonyms
Datelliptium Chloride105118-14-7Chlorure de datelliptiumDatelliptii chloridumV5QKF7Q20Ocloruro de datelliptioRefChem:130991Datelliptium (chloride)DetalliptiniumDatelliptium chloride [INN]2-(2-(Diethylamino)ethyl)-9-hydroxy-5,11-dimethyl-6H-pyrido(4,3-b)carbazolium chloride2-(2-(Diethylamino)ethyl)-9-hydroxy-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium chloride
Show more names
Datelliptium
2-[2-(diethylamino)ethyl]-9-hydroxy-5,11-dimethyl-6H-Pyrido[4,3-b]carbazolium, chloride (1:1)2-[2-(diethylamino)ethyl]-5,11-dimethyl-6H-pyrido[4,3-b]carbazol-2-ium-9-ol;chlorideCloruro de dateliptioNSC311152NSC-311152UNII-V5QKF7Q20ODatelliptii chloridum [Latin]Cloruro de dateliptio [Spanish]
Database identifiers
- CAS
105118-14-7- PubChem CID
- 72034
- ChEMBL
CHEMBL68332- UNII
- V5QKF7Q20O
Properties
Computed structural properties
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 496
Physicochemical properties
- storage temp.
- -20 °C · Store at -20°C
- solubility
- 5 · DMSO:5.0(Max Conc. mg/mL);12.56(Max Conc. mM)H2O:41.67(Max Conc. mg/mL);104.71(Max Conc. mM)
- form
- Solid
- color
- Pink to red
- FDA UNII
- 5 QKF7Q20O · V5QKF7Q20O
Chemistry & industry
Applications
UsesDatelliptium chloride is a DNA-intercalating agent derived from ellipticine, with anti-tumor activities.
Suppliers32 total
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
Aladdin Scientific[email protected]
上海微佳禾生物科技有限公司17502176150; 17502176150 · [email protected]
InvivoChem中国13549236410 · [email protected]
銳迪國際科技有限公司18024082417 · [email protected]
MedChemexpress LLC021-58955995 · [email protected]
上海瀚香生物科技有限公司177-54423994 17754423994 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
武汉壹加壹生物科技有限公司027-027-16602739303 16602739303 · [email protected]
上海楼岚生物科技有限公司021-52996696，15000506266 15000506266
杭州六可生物科技有限公司+86-0571-86912261 +86-15658003402 · [email protected]
上海泽涵生物医药科技有限公司021-61350663 13052117465 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…