(3R)-tert-butyl 3-(6-methoxy-2-morpholino-5-(5-(trifluoromethyl)benzo[d]thiazol-2-yl)pyrimidin-4-ylamino)piperidine-1-carboxylate
Basic information
- Standard SMILES
COc1nc(N2CCOCC2)nc(N[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1-c1nc2cc(C(F)(F)F)ccc2s1- InChIKey
ZVWUOFIXLSLTEW-QGZVFWFLSA-N- Molecular formula
- C27H33F3N6O4S
- Average molar mass
- 594.7 g/mol
Names & identifiers
- Preferred name
- (3R)-tert-butyl 3-(6-methoxy-2-morpholino-5-(5-(trifluoromethyl)benzo[d]thiazol-2-yl)pyrimidin-4-ylamino)piperidine-1-carboxylate
- IUPAC
- tert-butyl (3R)-3-[[6-methoxy-2-morpholin-4-yl-5-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]pyrimidin-4-yl]amino]piperidine-1-carboxylate
Names & synonyms
(3R)-tert-butyl 3-(6-methoxy-2-morpholino-5-(5-(trifluoromethyl)benzo[d]thiazol-2-yl)pyrimidin-4-ylamino)piperidine-1-carboxylateSCHEMBL14932341
Database identifiers
- PubChem CID
- 89554303
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 130 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 13
- Rotatable bonds
- 7
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 892
Related reactions
2 records
Compound notes
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