Basic information
- CAS
136449-85-9- Standard SMILES
CCCCCCCCCCCCC(=O)N1CCCCC1CNC(=O)C(N)CCCCN- InChIKey
HXQRGYNEDCHJPJ-WCSIJFPASA-N- Molecular formula
- C25H50N4O2
- Average molar mass
- 438.7 g/mol
- Monoisotopic mass
- 438.39337685
Overview
interacts with th C1 doamin of protein kinase C
Names & identifiers
- Preferred name
- Npc 15437
- IUPAC
- 2,6-diamino-N-[(1-tridecanoylpiperidin-2-yl)methyl]hexanamide
- English name
- NPC-15437 DIHYDROCHLORIDE
- Molecular formula
- C25H50N4O2
- Molecular weight
- 438.69
Names & synonyms
Npc 15437136449-85-9NPC-15437Hexanamide, 2,6-diamino-N-((1-(1-oxotridecyl)-2-piperidinyl)methyl)-RefChem:1668972,6-Diamino-N-((1-(oxotridecyl)-2-piperidinyl)methyl)hexanamide2,6-diamino-N-[(1-tridecanoylpiperidin-2-yl)methyl]hexanamideDTXSID70929436(2S)-2,6-Diamino-N-((1-tridecanoylpiperidin-2-yl)methyl)hexanamideSCHEMBL2746909DB-0820632,6-Diamino-N-[(1-tridecanoylpiperidin-2-yl)methyl]hexanimidic acid
Show more names
NPC154372HClNpc1537 dihydrochlorideNPC-15437 DIHYDROCHLORIDENPC-15437 hydrate dihydrochloride2,6-Diamino-N-[(1-tridecanoyl-2-piperidinyl)methyl]hexanamideHexanamide, 2,6-diamino-N-[[1-(1-oxotridecyl)-2-piperidinyl]methyl]-, (2S)-S-2,6-DIAMINO-N-([1-(1-OXOTRIDECYL)-2-PIPERIDINYL]METHYL)HEXANAMIDE DIHYDROCHLORIDE(2S)-2,6-DIAMINO-N-[[1-(1-OXOTRIDECYL)-2-PIPERIDINYL]METHYL]HEXANAMIDE DIHYDROCHLORIDES-2,6-DIAMINO-N-[[1'-(1'-OXOTRIDECYL)-2'-PIPERIDINYL]METHYL]HEXANAMIDE DIHYDROCHLORIDE
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 18
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 472
Physicochemical properties
- Boiling point
- 641.557 · 641.557±45.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 0.988 · 0.988±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- storage temp.
- 2 · 2-8°C
- solubility
- 2 O: · H2O: ≥36 mg/mL
- form
- solid
- pka
- 15.375 · 15.375±0.46(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
Suppliers4 total
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
VDM Biochemicals0330-2528181 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…