3-(4-Boc-1-piperazinyl)-4-methoxyaniline - CAS 148546-91-2
Catalog: |
BB010317 |
Product Name: |
3-(4-Boc-1-piperazinyl)-4-methoxyaniline |
CAS: |
148546-91-2 |
Synonyms: |
4-(5-amino-2-methoxyphenyl)-1-piperazinecarboxylic acid tert-butyl ester; tert-butyl 4-(5-amino-2-methoxyphenyl)piperazine-1-carboxylate |
IUPAC Name: | tert-butyl 4-(5-amino-2-methoxyphenyl)piperazine-1-carboxylate |
Description: | 3-(4-Boc-1-piperazinyl)-4-methoxyaniline (CAS# 148546-91-2 ) is a useful research chemical. |
Molecular Weight: | 307.39 |
Molecular Formula: | C16H25N3O3 |
Canonical SMILES: | CC(C)(C)OC(=O)N1CCN(CC1)C2=C(C=CC(=C2)N)OC |
InChI: | InChI=1S/C16H25N3O3/c1-16(2,3)22-15(20)19-9-7-18(8-10-19)13-11-12(17)5-6-14(13)21-4/h5-6,11H,7-10,17H2,1-4H3 |
InChI Key: | FYFXFHWPEFYDKI-UHFFFAOYSA-N |
LogP: | 2.91860 |
Publication Number | Title | Priority Date |
US-2014120036-A1 | Radiolabeled 5-ht6 ligands | 20120106 |
AU-2008320821-A1 | Benzenesulfonanilide compounds suitable for treating disorders that respond to modulation of the serotonin 5-HT6 receptor | 20071102 |
CA-2704529-A1 | Benzenesulfonanilide compounds suitable for treating disorders that respond to modulation of the serotonin 5-ht6 receptor | 20071102 |
EP-2217583-A1 | Benzenesulfonanilide compounds suitable for treating disorders that respond to modulation of the serotonin 5-ht6 receptor | 20071102 |
EP-2217583-B1 | Benzenesulfonanilide compounds suitable for treating disorders that respond to modulation of the serotonin 5-ht6 receptor | 20071102 |
Complexity: | 375 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 307.18959167 |
Formal Charge: | 0 |
Heavy Atom Count: | 22 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 307.18959167 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 68 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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Amines and Anilines
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