| CAS Number | 193538-32-8 |
| Catalog Number | AG019KCP(AGN-PC-00UXLV) |
| Chemical Name | 1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidine-4-carboxylic acid |
| IUPAC Name | 1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidine-4-carboxylic acid |
| InChI | InChI=1S/C11H16N2O2S/c1-8-12-10(7-16-8)6-13-4-2-9(3-5-13)11(14)15/h7,9H,2-6H2,1H3,(H,14,15) |
| InChI Key | KOKFIDGUSIUQIO-UHFFFAOYSA-N |
| MDL Number | MFCD08691322 |
| Molecular Formula | C11H16N2O2S |
| Molecular Weight | 240.3219 |
| SMILES | CC1SC=C(CN2CCC(C(O)=O)CC2)N=1 |
| Synonyms | 1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidine-4-carboxylic acid,
193538-32-8,
AC1Q2OXP,
SCHEMBL6994266,
CTK7J0210,
ZINC9690930,
AKOS009095111,
MCULE-8633071456,
NE21768,
EN300-26400,
Z197280520,
|
| Complexity | 254 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 240.093g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.321g/mol |
| Monoisotopic Mass | 240.093g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 81.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number