| CAS Number | 1447605-99-3 |
| Catalog Number | AG00HX76 |
| Chemical Name | BENZYL 1-BENZYL-4-METHYLPIPERAZINE-2-CARBOXYLATE |
| IUPAC Name | benzyl 1-benzyl-4-methylpiperazine-2-carboxylate |
| InChI | InChI=1S/C20H24N2O2/c1-21-12-13-22(14-17-8-4-2-5-9-17)19(15-21)20(23)24-16-18-10-6-3-7-11-18/h2-11,19H,12-16H2,1H3 |
| InChI Key | XJAUWQWRZFAKRH-UHFFFAOYSA-N |
| MDL Number | MFCD09037846 |
| Molecular Formula | C20H24N2O2 |
| Molecular Weight | 324.4168 |
| SMILES | CN1CCN(C(C1)C(=O)OCc1ccccc1)Cc1ccccc1 |
| Synonyms | BENZYL 1-BENZYL-4-METHYLPIPERAZINE-2-CARBOXYLATE,
1447605-99-3,
AB2647,
MFCD09037846,
AKOS027334802,
benzyl 1-benzyl 4-methylpiperazine-2-carboxylate,
|
| Complexity | 389 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 324.184g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 24 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 324.424g/mol |
| Monoisotopic Mass | 324.184g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 32.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number