Methyl (2S)-2-amino-3-[(triphenylmethyl)sulfanyl]propanoate - CAS 115545-85-2
Catalog: |
BB076149 |
Product Name: |
Methyl (2S)-2-amino-3-[(triphenylmethyl)sulfanyl]propanoate |
CAS: |
115545-85-2 |
Synonyms: |
(S)-Methyl 2-amino-3-(tritylthio)propanoate; METHYL (2S)-2-AMINO-3-[(TRIPHENYLMETHYL)SULFANYL]PROPANOATE; methyl (2S)-2-amino-3-tritylsulfanylpropanoate; D-Cysteine, S-(triphenylmethyl)-, methyl ester; S-Trityl-D-cysteine methyl ester |
IUPAC Name: | methyl (2S)-2-amino-3-tritylsulfanylpropanoate |
Description: | Methyl (2S)-2-amino-3-[(triphenylmethyl)sulfanyl]propanoate |
Molecular Weight: | 377.5 |
Molecular Formula: | C23H23NO2S |
Canonical SMILES: | COC(=O)C(CSC(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)N |
InChI: | InChI=1S/C23H23NO2S/c1-26-22(25)21(24)17-27-23(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-16,21H,17,24H2,1H3/t21-/m1/s1 |
InChI Key: | DXUZZMIANHJYIU-OAQYLSRUSA-N |
Solubility: | Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly) |
Appearance: | Colourless to Off-White Sticky Oil to Solid |
Storage: | -20°C Freezer, Under inert atmosphere |
Complexity: | 406 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 1 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 377.14495015 |
Formal Charge: | 0 |
Heavy Atom Count: | 27 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 377.14495015 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 77.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.6 |
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