Basic information
- CAS
31386-24-0- Standard SMILES
Cc1c(C)n(CCN(C)C)c2ccc(C(=O)OCCN(C)C)cc12- InChIKey
LOCIGFDPZFJXFT-UHFFFAOYSA-N- Molecular formula
- C19H29N3O2
- Average molar mass
- 331.5 g/mol
- Monoisotopic mass
- 331.22597718
Overview
Amindocate is a small molecule drug. Amindocate has a monoisotopic molecular weight of 331.23 Da.
Names & identifiers
- Preferred name
- Amindocate
- IUPAC
- 2-(dimethylamino)ethyl 1-[2-(dimethylamino)ethyl]-2,3-dimethylindole-5-carboxylate
- English name
- Amindocate
- Molecular formula
- C19H29N3O2
- Molecular weight
- 331.45
Names & synonyms
AmindocateAmindocato31386-24-0Amindocate [INN]AmindocatumDTXSID2046385UNII-5C193VF4V35C193VF4V32-(dimethylamino)ethyl 1-[2-(dimethylamino)ethyl]-2,3-dimethylindole-5-carboxylateDTXCID00263852-(Dimethylamino)ethyl 1-(2-(dimethylamino)ethyl)-2,3-dimethylindole-5-carboxylate2-Dimethylaminoethyl 1-(2-dimethylaminoethyl)-2,3-dimethylindol-5-carboxylat
Show more names
1-[2-(Dimethylamino)ethyl]-2,3-dimethyl-1H-indole-5-carboxylic acid 2-(dimethylamino)ethyl ester1H-Indole-5-carboxylic acid, 1-[2-(dimethylamino)ethyl]-2,3-dimethyl-, 2-(dimethylamino)ethyl ester
RefChem:111993NCGC00164483-01NCGC00164483-032-(dimethylamino)ethyl 1-[2-(dimethylamino)ethyl]-2,3-dimethyl-1H-indole-5-carboxylateCAS-31386-24-0ChemDiv3_000343Oprea1_602187Oprea1_783445
Database identifiers
- CAS
31386-24-0
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 37.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 413
Physicochemical properties
- Boiling point
- 465.3 · 465.3±45.0 °C(Predicted)
- Density
- 1.06 · 1.06±0.1 g/cm3(Predicted)
- pka
- 9.35 · 9.35±0.28(Predicted)
- FDA UNII
- 5 C193VF4V3 · 5C193VF4V3
Chemistry & industry
Suppliers1 total
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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