Terbequinil
Completing data — refresh the page later to see the latest
Basic information
- CAS
113079-82-6- Standard SMILES
CCCNC(=O)c1cn(COC)c2ccccc2c1=O- InChIKey
RIPDGZHPNKQLDC-UHFFFAOYSA-N- Molecular formula
- C15H18N2O3
- Average molar mass
- 274.31 g/mol
- Monoisotopic mass
- 274.13174244
Overview
Terbequinil is a small molecule drug. The usage of the INN stem '-nil' in the name indicates that Terbequinil is a benzodiazepine receptor antagonist/agonist. Terbequinil has a monoisotopic molecular weight of 274.13 Da.
Names & identifiers
- Preferred name
- Terbequinil
- IUPAC
- 1-(methoxymethyl)-4-oxo-N-propylquinoline-3-carboxamide
- English name
- Terbequinil
- Molecular formula
- C15H18N2O3
- Molecular weight
- 274.32
Names & synonyms
TerbequinilTerbequiniloTerbequinil [INN]TerbequinilumTerbequinilum [INN-Latin]Terbequinilo [INN-Spanish]UNII-0DH9WUS03O0DH9WUS03OSR 257761,4-Dihydro-1-(methoxymethyl)-4-oxo-N-propyl-3-quinolinecarboxamideDTXSID501502811-Methoxymethyl-4-oxo-1,4-dihydroquinoline 3-(N-propyl)carboxamide
Show more names
3-Quinolinecarboxamide, 1,4-dihydro-1-(methoxymethyl)-4-oxo-N-propyl-Terbequinilum (INN-Latin)Terbequinilo (INN-Spanish)RefChem:187922DTXCID0072772113079-82-61-(methoxymethyl)-4-oxo-N-propylquinoline-3-carboxamide1-(methoxymethyl)-4-oxo-N-propyl-1,4-dihydroquinoline-3-carboxamide
Database identifiers
- CAS
113079-82-6- PubChem CID
- 65916
- DTXSID
DTXSID50150281- ChEMBL
CHEMBL2105466- UNII
- 0DH9WUS03O
- Nikkaji
- J561.876B
Properties
Computed structural propertiesFilling in
- XLogP
- 2.6
- Topological polar surface area
- 58.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 406
Physicochemical properties
- Melting point
- 159 °C · 159 °C
- Boiling point
- 446.7 · 446.7±45.0 °C(Predicted)
- Density
- 1.181 · 1.181±0.06 g/cm3(Predicted)
- pka
- 12.85 · 12.85±0.20(Predicted)
- FDA UNII
- 0 DH9WUS03O · 0DH9WUS03O
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…