(R)-N-Fmoc-3-amino-4-(phenylthio)butanoic acid - CAS 1244724-97-7
Catalog: |
BB064760 |
Product Name: |
(R)-N-Fmoc-3-amino-4-(phenylthio)butanoic acid |
CAS: |
1244724-97-7 |
Synonyms: |
(R)-N-Fmoc-3-amino-4-(phenylthio)butanoic acid; (3R)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-phenylsulfanylbutanoic acid; (R)-N-Fmoc-3-amino-4-(phenylthio)butanoicAcid |
IUPAC Name: | (3R)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-phenylsulfanylbutanoic acid |
Description: | (R)-N-Fmoc-3-amino-4-(phenylthio)butanoic acid |
Molecular Weight: | 228.22 |
Molecular Formula: | C13H9FN2O |
Canonical SMILES: | C1=CC=C(C=C1)SCC(CC(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24 |
InChI: | InChI=1S/C25H23NO4S/c27-24(28)14-17(16-31-18-8-2-1-3-9-18)26-25(29)30-15-23-21-12-6-4-10-19(21)20-11-5-7-13-22(20)23/h1-13,17,23H,14-16H2,(H,26,29)(H,27,28)/t17-/m1/s1 |
InChI Key: | ZXVKPJJQNJPHQT-QGZVFWFLSA-N |
Complexity: | 586 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 433.13477939 |
Formal Charge: | 0 |
Heavy Atom Count: | 31 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 433.13477939 |
Rotatable Bond Count: | 9 |
Topological Polar Surface Area: | 101Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.8 |
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