Pyro(l-alpha-aminoadipyl)-L-histidyl-L-thiazolidine-4-carboxamide
Basic information
- CAS
64784-01-6- Standard SMILES
NC(=O)C1CSCN1C(=O)C(Cc1cnc[nH]1)NC(=O)C1CCCC(=O)N1- InChIKey
OGUDACTYCTVDNZ-UHFFFAOYSA-N- Molecular formula
- C16H22N6O4S
- Average molar mass
- 394.5 g/mol
- Monoisotopic mass
- 394.14232438
Overview
RN given refers to cpd without isomeric designation
Names & identifiers
- Preferred name
- Pyro(l-alpha-aminoadipyl)-L-histidyl-L-thiazolidine-4-carboxamide
- IUPAC
- 3-[3-(1H-imidazol-5-yl)-2-[(6-oxopiperidine-2-carbonyl)amino]propanoyl]-1,3-thiazolidine-4-carboxamide
- English name
- MK 771
- Molecular formula
- C16H22N6O4S
- Molecular weight
- 394.45
Names & synonyms
Pyro-aad-his-tzl-NH2Pyro(l-alpha-aminoadipyl)-L-histidyl-L-thiazolidine-4-carboxamide64784-01-6Pyro-2-aminoadipylhistidylthiazolidine-4-carboxyamideRefChem:177808(2S)-N-((2S)-1-((4S)-4-Carbamoyl-1,3-thiazolidin-3-yl)-3-(1H-imidazol-5-yl)-1-oxo-2-propanyl)-6-oxo-2-piperidinecarboxamide2-Piperidinecarboxamide, N-(2-(4-(aminocarbonyl)-3-thiazolidinyl)-1-(1H-imidazol-4-ylmethyl)-2-oxoethyl)-6-oxo-MK 771[2S-[2R*[R*(R*)]]]-N-[2-[4-(aminocarbonyl)-3-thiazolidinyl]-1-(1H-imidazol-4-ylmethyl)-2-oxoethyl]-6-oxopiperidine-2-carboxamideSCHEMBL13322941DTXSID709833962-Piperidinecarboxamide, N-(2-(4-(aminocarbonyl)-3-thiazolidinyl)-1-(1H- imidazol-4-ylmethyl)-2-oxoethyl)-6-oxo-
Show more names
2-Piperidinecarboxamide, N-[2-[4-(aminocarbonyl)-3-thiazolidinyl]-1-(1H-imidazol-5-ylmethyl)-2-oxoethyl]-6-oxo-
6-Hydroxy-N-[1-{4-[hydroxy(imino)methyl]-1,3-thiazolidin-3-yl}-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-2,3,4,5-tetrahydropyridine-2-carboximidic acid
Properties
Computed structural properties
- XLogP
- -2.1
- Topological polar surface area
- 176 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 618
Physicochemical properties
- FDA UNII
- 600 CO0BM · BU600CO0BM
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
Mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions. Several MONOAMINE OXIDASE INHIBITORS are useful as antidepressants apparently as a long-term consequence of their modulation of catecholamine levels. The tricyclic compounds useful as antidepressive agents (ANTIDEPRESSIVE AGENTS, TRICYCLIC) also appear to act through brain catecholamine systems. A third group (ANTIDEPRESSIVE AGENTS, SECOND-GENERATION) is a diverse group of drugs including some that act specifically on serotonergic systems.
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Compound notes
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