Basic information
- Standard SMILES
Cc1nc(-n2ccc(OCc3ccccc3)cc2=O)sc1C(=O)NCc1ccc(C)n1C- InChIKey
PHWXVTCQCDBAFO-UHFFFAOYSA-N- Molecular formula
- C24H24N4O3S
- Average molar mass
- 448.5 g/mol
- Monoisotopic mass
- 448.15691181
Names & identifiers
- Preferred name
- 2-(4-(Benzyloxy)-2-oxopyridin-1(2H)-yl)-N-((1,5-dimethyl-1H-pyrrol-2-yl)methyl)-4-methylthiazole-5-carboxamide
- IUPAC
- N-[(1,5-dimethylpyrrol-2-yl)methyl]-4-methyl-2-(2-oxo-4-phenylmethoxy-1-pyridinyl)-1,3-thiazole-5-carboxamide
Names & synonyms
SCHEMBL3368015PHWXVTCQCDBAFO-UHFFFAOYSA-N2-(4-(Benzyloxy)-2-oxopyridin-1(2H)-yl)-N-((1,5-dimethyl-1H-pyrrol-2-yl)methyl)-4-methylthiazole-5-carboxamide
Database identifiers
- PubChem CID
- 57744517
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 105 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 752
Related reactions
2 records
Compound notes
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