1246471-35-1 Purity
---
If you have any other questions or need other size, please get a quote.
The molecular formula is C25H23NO4S.
The synonyms are (3R)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-phenylsulfanylbutanoic acid and Butanoic acid, 3-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-4-(phenylthio)-, (3R)-.
The molecular weight is 433.5 g/mol.
The IUPAC name is (3R)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-phenylsulfanylbutanoic acid.
The InChI is 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.
The InChIKey is ZXVKPJJQNJPHQT-QGZVFWFLSA-N.
The canonical SMILES is C1=CC=C(C=C1)SCC(CC(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24.
The XLogP3-AA value is 4.8.
Yes, it is a canonicalized compound.