| CAS Number | 820231-21-8 |
| Catalog Number | AG00G8S3(AGN-PC-0UL8BC) |
| Chemical Name | tert-Butyl 4-(2-aminothiazol-5-yl)piperidine-1-carboxylate |
| IUPAC Name | tert-butyl 4-(2-amino-1,3-thiazol-5-yl)piperidine-1-carboxylate |
| InChI | InChI=1S/C13H21N3O2S/c1-13(2,3)18-12(17)16-6-4-9(5-7-16)10-8-15-11(14)19-10/h8-9H,4-7H2,1-3H3,(H2,14,15) |
| InChI Key | FCQTZASBYBRYGM-UHFFFAOYSA-N |
| MDL Number | MFCD24467163 |
| Molecular Formula | C13H21N3O2S |
| Molecular Weight | 283.3897 |
| SMILES | NC=1SC(=CN1)C1CCN(CC1)C(=O)OC(C)(C)C |
| Synonyms | 820231-21-8,
tert-butyl 4-(2-aminothiazol-5-yl)piperidine-1-carboxylate,
tert-butyl 4-(2-amino-1,3-thiazol-5-yl)piperidine-1-carboxylate,
SCHEMBL3897024,
FCQTZASBYBRYGM-UHFFFAOYSA-N,
ZINC59581250,
AKOS033769222,
DA-41289,
FT-0735883,
Z2130643642,
|
| Complexity | 324 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 283.135g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 283.39g/mol |
| Monoisotopic Mass | 283.135g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 96.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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Certificate of Analysis
Lot Number