Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCC(Oc2c(C#N)cnc3ccc(/C=C4\SC(N)=NC4=O)cc23)CC1- InChIKey
BWFZUMSFGDHJKF-ODLFYWEKSA-N- Molecular formula
- C24H25N5O4S
- Average molar mass
- 479.6 g/mol
- Monoisotopic mass
- 479.16272547
Names & identifiers
- Preferred name
- 4-{6-[2-Amino-4-oxo-4h-thiazol-(5z)-ylidenemethyl]-3-cyano-quinolin-4-yloxy}-piperidine-1-carboxylic acid tert-butyl ester
- IUPAC
- tert-butyl 4-[6-[(Z)-(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]-3-cyanoquinolin-4-yl]oxypiperidine-1-carboxylate
Names & synonyms
BWFZUMSFGDHJKF-ODLFYWEKSA-N4-{6-[2-amino-4-oxo-4h-thiazol-(5z)-ylidenemethyl]-3-cyano-quinolin-4-yloxy}-piperidine-1-carboxylic acid tert-butyl ester
Database identifiers
- PubChem CID
- 11655928
Properties
Computed structural propertiesFilling in
- XLogP
- 3.3
- Topological polar surface area
- 156 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 912
Related reactions
2 records
Compound notes
Loading…