151545-15-2
BOC-S-[2-(4-PYRIDYL)ETHYL]-L-CYSTEINE
NameBOC-S-[2-(4-PYRIDYL)ETHYL]-L-CYSTEINE
1Identification
【Name】
BOC-S-[2-(4-PYRIDYL)ETHYL]-L-CYSTEINE
【CAS】
【MDL】
MFCD02682562
【English Synonyms】
【Formula】
C15 H22 N2 O4 S
【MolWeight】
326.415
【Inchi】
InChI=1S/C15H22N2O4S/c1-15(2,3)21-14(20)17-12(13(18)19)10-22-9-6-11-4-7-16-8-5-11/h4-5,7-8,12H,6,9-10H2,1-3H3,(H,17,20)(H,18,19)/t12-/m0/s1
【InChIKey】
InChIKey=VVTDUMYLIKYKGJ-LBPRGKRZSA-N
【SMILES】
CC(C)(C)OC(=O)N[C@@H](CSCCc1ccncc1)C(=O)O
【MOL File】
BOC-S-[2-(4-PYRIDYL)….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
BOC-S-[2-(4-PYRIDYL)ETHYL]-L-CYSTEINE.cml