Thieno(2,3-c)pyridine-3-carboxylic acid, 4,5,6,7-tetrahydro-2-amino-6-phenethyl-, ethyl ester, monohydrochloride
Basic information
- CAS
29635-14-1- Standard SMILES
CCOC(=O)c1c(N)sc2c1CCN(CCc1ccccc1)C2.Cl- InChIKey
YBKSUECEFSNKDM-UHFFFAOYSA-N- Molecular formula
- C18H23ClN2O2S
- Average molar mass
- 366.9 g/mol
- Monoisotopic mass
- 366.1168768
Names & identifiers
- Preferred name
- Thieno(2,3-c)pyridine-3-carboxylic acid, 4,5,6,7-tetrahydro-2-amino-6-phenethyl-, ethyl ester, monohydrochloride
- IUPAC
- ethyl 2-amino-6-(2-phenylethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylate;hydrochloride
Names & synonyms
Thieno(2,3-c)pyridine-3-carboxylic acid, 4,5,6,7-tetrahydro-2-amino-6-phenethyl-, ethyl ester, monohydrochloride4,5,6,7-Tetrahydro-2-amino-6-phenethylthieno(2,3-c)pyridine-3-carboxylic acid ethyl ester HCl29635-14-1DTXSID70183814RefChem:384938DTXCID10106305Ethyl 2-amino-6-(2-phenylethyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carboxylate--hydrogen chloride (1/1)
Database identifiers
- CAS
29635-14-1- PubChem CID
- 207315
- DTXSID
DTXSID70183814
Properties
Computed structural properties
- Topological polar surface area
- 83.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 400
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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