3-Methoxypropyl Z-L-Alaninamide - CAS 1420804-56-3
Catalog: |
BB075902 |
Product Name: |
3-Methoxypropyl Z-L-Alaninamide |
CAS: |
1420804-56-3 |
Synonyms: |
3-METHOXYPROPYL Z-L-ALANINAMIDE; benzyl N-[(2S)-1-(3-methoxypropylamino)-1-oxopropan-2-yl]carbamate; 3-METHOXYPROPYLZ-L-ALANINAMIDE; BENZYL N-[(1S)-1-[(3-METHOXYPROPYL)CARBAMOYL]ETHYL]CARBAMATE |
IUPAC Name: | benzyl N-[(2S)-1-(3-methoxypropylamino)-1-oxopropan-2-yl]carbamate |
Description: | 3-Methoxypropyl Z-L-Alaninamide |
Molecular Weight: | 294.35 |
Molecular Formula: | C15H22N2O4 |
Canonical SMILES: | CC(C(=O)NCCCOC)NC(=O)OCC1=CC=CC=C1 |
InChI: | InChI=1S/C15H22N2O4/c1-12(14(18)16-9-6-10-20-2)17-15(19)21-11-13-7-4-3-5-8-13/h3-5,7-8,12H,6,9-11H2,1-2H3,(H,16,18)(H,17,19)/t12-/m0/s1 |
InChI Key: | SAVSELWCSLOACS-LBPRGKRZSA-N |
Complexity: | 317 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 294.15795719 |
Formal Charge: | 0 |
Heavy Atom Count: | 21 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 294.15795719 |
Rotatable Bond Count: | 9 |
Topological Polar Surface Area: | 76.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.4 |
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