AC1L6OAA
methyl 2-[[3-benzylsulfanyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]-3-phenylpropanoate
Also Known As: methyl 2-[[3-benzylsulfanyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]-3-phenylpropanoate|methyl S-benzyl-N-[(benzyloxy)carbonyl]cysteinylphenylalaninate
CAS: 7625-12-9
| Molecular Formula | C28H30N2O5S |
|---|---|
| Molecular Weight | 506.18753 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 14 |
| Exact Mass | 506.18753 |
| Monoisotopic Mass | 506.18753 |
| Heavy Atoms | 36 |
| Complexity | 673.0 |
Chemical Identifiers
| CAS Number | 7625-12-9 |
|---|---|
| SMILES | COC(=O)C(CC1=CC=CC=C1)NC(=O)C(CSCC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3 |
| InChIKey | XPDRBGYULOKZFN-UHFFFAOYSA-N |
Product Overview
AC1L6OAA (CAS 7625-12-9), with molecular formula C28H30N2O5S and molecular weight 506.18753 g/mol. IUPAC: methyl 2-[[3-benzylsulfanyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]-3-phenylpropanoate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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