1173289-66-1
(S)-2-(3-BENZOYLPHENYL)-N-(4-HYDROXYPHENETHYL)-N-ISOPROPYLPROPANAMIDE
Name(S)-2-(3-BENZOYLPHENYL)-N-(4-HYDROXYPHENETHYL)-N-ISOPROPYLPROPANAMIDE
1Identification
【Name】
(S)-2-(3-BENZOYLPHENYL)-N-(4-HYDROXYPHENETHYL)-N-ISOPROPYLPROPANAMIDE
【CAS】
【MDL】
MFCD17011845
【English Synonyms】
【Formula】
C27 H29 N O3
【MolWeight】
415.53
【Inchi】
InChI=1S/C27H29NO3/c1-19(2)28(17-16-21-12-14-25(29)15-13-21)27(31)20(3)23-10-7-11-24(18-23)26(30)22-8-5-4-6-9-22/h4-15,18-20,29H,16-17H2,1-3H3/t20-/m0/s1
【InChIKey】
InChIKey=WLGHEZSFCNGLGM-FQEVSTJZSA-N
【SMILES】
CC(C)N(CCc1ccc(cc1)O)C(=O)[C@@H](C)c2cccc(c2)C(=O)c3ccccc3
【MOL File】
(S)-2-(3-BENZOYLPHEN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:5.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
(S)-2-(3-BENZOYLPHENYL)-N-(4-HYDROXYPHENETHYL)-N-ISOPROPYLPROPANAMIDE.cml