Basic information
- CAS
1572184-68-9- Standard SMILES
Cc1cc(C)c(OCC(=O)N/N=C/c2ccc3cc[nH]c3c2)c(C2CCOCC2)c1- InChIKey
GKDSQRIJIGRMRV-VULFUBBASA-N- Molecular formula
- C24H27N3O3
- Average molar mass
- 405.5 g/mol
- Monoisotopic mass
- 405.20524173
Names & identifiers
- Preferred name
- (E)-N'-((1H-Indol-6-yl)methylene)-2-(2-(tetrahydro-2H-pyran-4-yl)-4,6-dimethylphenoxy)acetohydrazide
- IUPAC
- 2-[2,4-dimethyl-6-(oxan-4-yl)phenoxy]-N-[(E)-1H-indol-6-ylmethylideneamino]acetamide
- English name
- (E)-N-((1H-INDOL-6-YL)METHYLENE)-2-(2-(TETRAHYDRO-2H-PYRAN-4-YL)-4,6-DIMETHYLPHENOXY)ACETOHYDRAZIDE
- Molecular formula
- C24H27N3O3
- Molecular weight
- 405.49
Names & synonyms
1572184-68-9(E)-N'-((1H-Indol-6-yl)methylene)-2-(2-(tetrahydro-2H-pyran-4-yl)-4,6-dimethylphenoxy)acetohydrazide(E)-N'-((1H-Indol-6-yl)methylene)-2-(2,4-dimethyl-6-(tetrahydro-2H-pyran-4-yl)phenoxy)acetohydrazideMFCD286571782-[2,4-dimethyl-6-(oxan-4-yl)phenoxy]-N-[(E)-1H-indol-6-ylmethylideneamino]acetamideC24H27N3O3SCHEMBL155190802-[2,4-dimethyl-6-(oxan-4-yl)phenoxy]-N'-[(E)-(1H-indol-6-yl)methylidene]acetohydrazideAKOS027324316AS-41182SY033106CS-0447387
Show more names
(E)-N-((1H-INDOL-6-YL)METHYLENE)-2-(2,4-DIMETHYL-6-(TETRAHYDRO-2H-PYRAN-4-YL)PHENOXY)ACETOHYDRAZIDE(E)-N-((1H-INDOL-6-YL)METHYLENE)-2-(2-(TETRAHYDRO-2H-PYRAN-4-YL)-4,6-DIMETHYLPHENOXY)ACETOHYDRAZIDEAcetic acid, 2-[2,4-dimethyl-6-(tetrahydro-2H-pyran-4-yl)phenoxy]-, (2E)-2-(1H-indol-6-ylmethylene)hydrazide
F770427(E)-N inverted exclamation mark -[(6-Indolyl)methylene]-2-[2,4-dimethyl-6-(4-tetrahydropyranyl)phenoxy]acetohydrazide2-(2,4-dimethyl-6-tetrahydropyran-4-yl-phenoxy)-N-[(E)-1H-indol-6-ylmethyleneamino]acetamide
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 75.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 592
Physicochemical properties
- Density
- 1.23 · 1.23±0.1 g/cm3(Predicted)
- pka
- 12.13 · 12.13±0.46(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
Chemistry & industry
Suppliers4 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
江苏艾康生物医药研发有限公司025-5885952 15955137747 · [email protected]
北京六合宁远医药科技股份有限公司010-60400365-8001 15910885229 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…