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Basic information
- CAS
113713-24-9- Standard SMILES
COc1ccc2[nH]c(SCc3ncc(C)c(OC)c3C)nc2n1- InChIKey
ZZRLRRBNMPMTIL-UHFFFAOYSA-N- Molecular formula
- C16H18N4O2S
- Average molar mass
- 330.4 g/mol
- Monoisotopic mass
- 330.11504682
Names & identifiers
- Preferred name
- 5-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]thio]-1H-imidazo[4,5b]pyridine
- IUPAC
- 5-methoxy-2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methylsulfanyl]-1H-imidazo[4,5-b]pyridine
- English name
- 5-Methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]thio]-1H-imidazo[4,5b]pyridine
- Molecular formula
- C16H18N4O2S
- Molecular weight
- 330.4
Names & synonyms
113713-24-95-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]thio]-1H-imidazo[4,5b]pyridine5-methoxy-2-[(4-methoxy-3,5-dimethylpyridin-2-yl)methylsulfanyl]-1H-imidazo[4,5-b]pyridinetenatoprazole sulfideZZRLRRBNMPMTIL-UHFFFAOYSA-NTU-501SXK6H73NF8SCHEMBL2049960DTXSID00431693TU501AKOS015911820AB21026
Show more names
5-Methoxy-2-(((4-Methoxy-3,5-diMethylpyridin-2-yl)Methyl)thio)-1H-benzo[d]iMidazole5-Methoxy-2-(4-methoxy-3,5-dimethylpyridin-2-yl)methylthio)-3H-imidazo[4,5-b]pyridineTENA-0055-METHOXY-2-[[(4-METHOXY-3,5-DIMETHYL-2-PYRIDINYL)METHYL]THI...5-METHOXY-2[[(4-METHOXY-3,5-DIMETHYL-2-PYRIDINYL)-2-METHYL]THIO]-1H-BENZIMIDAZOLE3H-Imidazo[4,5-b]pyridine, 5-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]thio]-
4-METHOXY-2-[({5-METHOXY-1H-IMIDAZO[4,5-B]PYRIDIN-2-YL}SULFANYL)METHYL]-3,5-DIMETHYLPYRIDINEAC-12824DA-194402-[2-[(4-Methoxy-3,5-dimethyl-2-pyridinyl)methyl]thio]-5-methoxyimidazo[4,5-b]pyridine5-methoxy-2-(((4-methoxy-3,5-dimethylpyridin-2-yl)methyl)thio)-1H-imidazo[4,5-b]pyridine5-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)-methyl]thio]imidazo[4,5-b]pyridine5-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]thio]-3H-Imidazo[4,5-b]pyridine5-methoxy-2-[[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]thio]imidazo[4,5-b]-pyridine
Properties
Computed structural propertiesFilling in
- XLogP
- 3.1
- Topological polar surface area
- 98.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 389
Physicochemical properties
- Melting point
- 152 · 152-154 °C(Solv: dichloromethane (75-09-2))
- Boiling point
- 511 · 511.0±60.0 °C(Predicted)
- Density
- 1.33 · 1.33±0.1 g/cm3(Predicted)
- pka
- 5.83 · 5.83±0.40(Predicted)
Chemistry & industry
Suppliers17 total
广州济成进出口贸易有限公司13682223272 · [email protected]
大赛璐药物手性技术（上海）有限公司021-50460086-9 15921403865 · [email protected]
上海偕腾生物科技有限公司+86-021-58975553 · [email protected]
贵州易妥化学科技有限公司18628235590 · [email protected]
上海拓目化工有限公司13391076197 · [email protected]
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [email protected]
陕西缔都医药化工有限公司029-81154043 17391733319 · [email protected]
广州千行进出口有限公司020-37651955 13682223272 · [email protected]
ANHUI WITOP BIOTECH CO., LTD+8618071025641 · [email protected]
济南光尘医药科技有限公司18563726319 · [email protected]
常州优瑞医药科技有限公司18168818882 · [email protected]
SHANGHAI KEAN TECHNOLOGY CO., LTD.+8613817748580 · [email protected]
重庆卡兰医药有限公司[email protected]
上海齐奥化工科技有限公司021-58892003 · [email protected]
Related reactions
5 records
Compound notes
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