N,1-Di-Boc-3-(4-bromophenyl)-3-azetidinamine - CAS 1864803-36-0
Catalog: |
BB014325 |
Product Name: |
N,1-Di-Boc-3-(4-bromophenyl)-3-azetidinamine |
CAS: |
1864803-36-0 |
Synonyms: |
3-(4-bromophenyl)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-azetidinecarboxylic acid tert-butyl ester; tert-butyl 3-(4-bromophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]azetidine-1-carboxylate |
IUPAC Name: | tert-butyl 3-(4-bromophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]azetidine-1-carboxylate |
Description: | N,1-Di-Boc-3-(4-bromophenyl)-3-azetidinamine (CAS# 1864803-36-0 ) is a useful research chemical. |
Molecular Weight: | 427.33 |
Molecular Formula: | C19H27BrN2O4 |
Canonical SMILES: | CC(C)(C)OC(=O)NC1(CN(C1)C(=O)OC(C)(C)C)C2=CC=C(C=C2)Br |
InChI: | InChI=1S/C19H27BrN2O4/c1-17(2,3)25-15(23)21-19(13-7-9-14(20)10-8-13)11-22(12-19)16(24)26-18(4,5)6/h7-10H,11-12H2,1-6H3,(H,21,23) |
InChI Key: | DYLQSUHINJTGTI-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
US-10513521-B2 | Compositions and methods for inhibiting BMP | 20140715 |
US-2017197968-A1 | Compositions and Methods for Inhibiting BMP | 20140715 |
WO-2016011019-A1 | Compositions and methods for inhibiting bmp | 20140715 |
Complexity: | 525 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 426.11542 |
Formal Charge: | 0 |
Heavy Atom Count: | 26 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 426.11542 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 67.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.6 |
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Azetidines
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