Basic information
- Standard SMILES
CCOC(=O)c1sc(N2CCC(NC(=O)c3nc(Cl)c(CC)[nH]3)C(OCC)C2)nc1C(=O)NC(C)OC- InChIKey
DVCSEGCKUDOQLH-UHFFFAOYSA-N- Molecular formula
- C23H33ClN6O6S
- Average molar mass
- 557.1 g/mol
Names & identifiers
- Preferred name
- ethyl 2-[4-[(4-chloro-5-ethyl-1H-imidazole-2-carbonyl)amino]-3-ethoxypiperidin-1-yl]-4-(1-methoxyethylcarbamoyl)-1,3-thiazole-5-carboxylate
- IUPAC
- ethyl 2-[4-[(4-chloro-5-ethyl-1H-imidazole-2-carbonyl)amino]-3-ethoxypiperidin-1-yl]-4-(1-methoxyethylcarbamoyl)-1,3-thiazole-5-carboxylate
Names & synonyms
SCHEMBL2849343
Database identifiers
- PubChem CID
- 68415764
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 176 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 12
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 799
Related reactions
1 records
Compound notes
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