3-(Boc-amino)-3-(4-chlorophenyl)-1-propylamine - CAS 885595-59-5
Catalog: |
BB039005 |
Product Name: |
3-(Boc-amino)-3-(4-chlorophenyl)-1-propylamine |
CAS: |
885595-59-5 |
Synonyms: |
N-[3-amino-1-(4-chlorophenyl)propyl]carbamic acid tert-butyl ester; tert-butyl N-[3-amino-1-(4-chlorophenyl)propyl]carbamate |
IUPAC Name: | tert-butyl N-[3-amino-1-(4-chlorophenyl)propyl]carbamate |
Description: | 3-(Boc-amino)-3-(4-chlorophenyl)-1-propylamine (CAS# 885595-59-5 ) is a useful research chemical. |
Molecular Weight: | 284.78 |
Molecular Formula: | C14H21ClN2O2 |
Canonical SMILES: | CC(C)(C)OC(=O)NC(CCN)C1=CC=C(C=C1)Cl |
InChI: | InChI=1S/C14H21ClN2O2/c1-14(2,3)19-13(18)17-12(8-9-16)10-4-6-11(15)7-5-10/h4-7,12H,8-9,16H2,1-3H3,(H,17,18) |
InChI Key: | ASWDIABJPCJCQT-UHFFFAOYSA-N |
LogP: | 4.34580 |
Publication Number | Title | Priority Date |
AU-2008309383-A1 | Pyrrolo [2, 3 -D] pyrimidin derivatives as protein kinase B inhibitors | 20071011 |
AU-2008309383-B2 | Pyrrolo [2, 3 -D] pyrimidin derivatives as protein kinase B inhibitors | 20071011 |
CA-2701057-A1 | Pyrrolo[2,3-d]pyrimidin derivatives as protein kinase b inhibitors | 20071011 |
CA-2701057-C | Pyrrolo[2,3-d]pyrimidin derivatives as protein kinase b inhibitors | 20071011 |
EP-2201012-A1 | Pyrrolo [2, 3 -d] pyrimidin derivatives as protein kinase b inhibitors | 20071011 |
Complexity: | 284 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 284.1291556 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 284.1291556 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 64.4 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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