Basic information
- CAS
155204-23-2- Standard SMILES
COc1ccccc1N1CCN(CCN(C(=O)c2ccc(I)cc2)c2ccccn2)CC1- InChIKey
DHMLNZRDVQLQBB-UHFFFAOYSA-N- Molecular formula
- C25H27IN4O2
- Average molar mass
- 542.4 g/mol
- Monoisotopic mass
- 542.11787
Overview
increases short-term modulation of the exercise ventilatory response in goats
Names & identifiers
- Preferred name
- 4-iodo-N-(2-(4-(methoxyphenyl)-1-piperazinyl)ethyl)-N-2-pyridinylbenzamide
- IUPAC
- 4-iodo-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-N-pyridin-2-ylbenzamide
- English name
- 4-IODO-N-[2-[4-(METHOXYPHENYL)-1-PIPERAZINYL]ETHYL]-N-2-PYRIDINYL-BENZAMIDE HYDROCHLORIDE
- Molecular formula
- C25H27IN4O2
- Molecular weight
- 542.41
Names & synonyms
MPPI cpdRefChem:969674-iodo-n-(2-(4-(methoxyphenyl)-1-piperazinyl)ethyl)-n-2-pyridinylbenzamidep-MPPI155204-23-2MFCD105659104-iodo-N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-N-pyridin-2-ylbenzamide4-(2'-methoxyphenyl)-1-(2'-(N-(2''-pyridinyl)-4-iodobenzamido)ethyl)piperazine4-Iodo-N-[2-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl]-N-(2-pyridyl)benzamide4-Iodo-N-[2-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl]-N-2-pyridinylbenzamideCHEMBL290274-Mppi
Show more names
P-MPPI HYDROCHLORIDEBenzamide,4-iodo-N-[2-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl]-N-2-pyridinyl-4-(2’-methoxyphenyl)-1-(2’-(n-(2’’-pyridinyl)-4-iodobenzamido)ethyl)piperazine
benzamide, 4-iodo-n-[2-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl]-n-2-pyridinyl-4-iodo-N-[2-[4-(methoxyphenyl)-1-piperazinyl]ethyl]-N-2-pyridinyl-benzamide hydrochloride4-Iodo-N-(2-(4-(2-methoxyphenyl)-1-piperazinyl)ethyl)-N-2-pyridinylbenzamide4-Iodo-N-(2-(4-(2-methoxyphenyl)piperazin-1-yl)ethyl)-N-(pyridin-2-yl)benzamide4-iodo-N-{2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl}-N-(pyridin-2-yl)benzamide4-Iodo-N-{2-[4-(2-methoxy-phenyl)-piperazin-1-yl]-ethyl}-N-pyridin-2-yl-benzamideBenzamide, 4-iodo-N-(2-(4-(2-methoxyphenyl)-1-piperazinyl)ethyl)-N-2-pyridinyl-C25H27IN4O2
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 48.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 578
Physicochemical properties
- Boiling point
- 657.5 · 657.5±55.0 °C(Predicted)
- Density
- 1.46 · 1.460±0.06 g/cm3(Predicted)
- solubility
- 2 O: · H2O: 2.4 mg/mL
- form
- solid
- pka
- 6.68 · 6.68±0.40(Predicted)
- color
- white
- WGK Germany
- 3 · 3
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
Chemistry & industry
Suppliers6 total
韶远科技（上海）有限公司4000665055 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
上海辅欣医药科技有限公司021-50872116 13391048226 · [email protected]
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
Accela ChemBio Inc.+1-858-6993322 +86-18019713315 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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