(S)-3-(Cbz-amino)-2-oxoazepane - CAS 103478-12-2
Catalog: |
BB001146 |
Product Name: |
(S)-3-(Cbz-amino)-2-oxoazepane |
CAS: |
103478-12-2 |
Synonyms: |
N-[(3S)-2-oxo-3-azepanyl]carbamic acid (phenylmethyl) ester; benzyl N-[(3S)-2-oxoazepan-3-yl]carbamate |
IUPAC Name: | benzyl N-[(3S)-2-oxoazepan-3-yl]carbamate |
Description: | (S)-3-(Cbz-amino)-2-oxoazepane (CAS# 103478-12-2) is a useful research chemical compound. |
Molecular Weight: | 262.30 |
Molecular Formula: | C14H18N2O3 |
Canonical SMILES: | C1CCNC(=O)C(C1)NC(=O)OCC2=CC=CC=C2 |
InChI: | InChI=1S/C14H18N2O3/c17-13-12(8-4-5-9-15-13)16-14(18)19-10-11-6-2-1-3-7-11/h1-3,6-7,12H,4-5,8-10H2,(H,15,17)(H,16,18)/t12-/m0/s1 |
InChI Key: | ZFWYCTUOFGJWRJ-LBPRGKRZSA-N |
Storage: | Sealed in dry, 2-8 °C |
MDL: | MFCD08060107 |
LogP: | 2.30120 |
Publication Number | Title | Priority Date |
CA-2469610-A1 | Method for preparing sulphostin and analogue thereof or preparation intermediate thereof | 20011217 |
EP-1457494-A1 | Processes for preparation of sulphostin and its analogues or intermediates thereof | 20011217 |
JP-2003183292-A | Method for producing intermediate for producing sulfostine and its analogs | 20011217 |
JP-4059667-B2 | Process for producing intermediates of sulfostine and its analogs | 20011217 |
US-2005020834-A1 | Method for preparation of sulphostin and its analogue or intermediates thereof | 20011217 |
Complexity: | 314 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 262.13174244 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 262.13174244 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 67.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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