| CAS Number | 1704074-10-1 |
| Catalog Number | AG019EOI(AGN-PC-0WCRNG) |
| Chemical Name | (3-((1-(tert-Butoxycarbonyl)piperidin-4-yl)carbamoyl)phenyl)boronic acid |
| IUPAC Name | [3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]carbamoyl]phenyl]boronic acid |
| InChI | InChI=1S/C17H25BN2O5/c1-17(2,3)25-16(22)20-9-7-14(8-10-20)19-15(21)12-5-4-6-13(11-12)18(23)24/h4-6,11,14,23-24H,7-10H2,1-3H3,(H,19,21) |
| InChI Key | TZFYLPVMLOKGKX-UHFFFAOYSA-N |
| MDL Number | MFCD28384301 |
| Molecular Formula | C17H25BN2O5 |
| Molecular Weight | 348.2018 |
| SMILES | C(C)(C)(C)OC(=O)N1CCC(CC1)NC(=O)C=1C=C(C=CC1)B(O)O |
| Synonyms | (3-((1-(tert-butoxycarbonyl)piperidin-4-yl)carbamoyl)phenyl)boronic acid,
1704074-10-1,
MFCD28384301,
ZINC230545893,
AM88390,
CS-0060988,
(3-((1-(t-Butoxycarbonyl)piperidin-4-yl)carbamoyl)phenyl)boronic acid,
|
| Complexity | 472 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 348.186g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 348.206g/mol |
| Monoisotopic Mass | 348.186g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 99.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
Lot Number