579525-54-5
(S)-METHYL 2-AMINO-3-(3,5-DICHLORO-4-((2-PHENYLBENZO[D]OXAZOL-7-YL)METHOXY)PHENYL)PROPANOATE HYDROCHLORIDE
Name(S)-METHYL 2-AMINO-3-(3,5-DICHLORO-4-((2-PHENYLBENZO[D]OXAZOL-7-YL)METHOXY)PHENYL)PROPANOATE HYDROCHLORIDE
FormulaC24 H20 Cl2 N2 O4 . Cl H
1Identification
【Name】
(S)-METHYL 2-AMINO-3-(3,5-DICHLORO-4-((2-PHENYLBENZO[D]OXAZOL-7-YL)METHOXY)PHENYL)PROPANOATE HYDROCHLORIDE
【CAS】
【MDL】
MFCD17676146
【English Synonyms】
【Formula】
C24 H20 Cl2 N2 O4 . Cl H
【MolWeight】
507.799
【Inchi】
InChI=1S/C24H20Cl2N2O4.ClH/c1-30-24(29)19(27)12-14-10-17(25)22(18(26)11-14)31-13-16-8-5-9-20-21(16)32-23(28-20)15-6-3-2-4-7-15;/h2-11,19H,12-13,27H2,1H3;1H/t19-;/m0./s1
【InChIKey】
InChIKey=OGDDOLDDSDEQGQ-FYZYNONXSA-N
【SMILES】
COC(=O)[C@H](Cc1cc(c(c(c1)Cl)OCc2cccc3c2oc(n3)c4ccccc4)Cl)N.Cl
【MOL File】
(S)-METHYL 2-AMINO-3….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:5.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
(S)-METHYL 2-AMINO-3-(3,5-DICHLORO-4-((2-PHENYLBENZO[D]OXAZOL-7-YL)METHOXY)PHENYL)PROPANOATE HYDROCHLORIDE.cml