77383-32-5
ALPHA-(4-OCTADECANYLAMINO)-BENZOYL-ALPHA-PHENOXY-N-(2-CHLORPHENYL)-ACETAMIDE
NameALPHA-(4-OCTADECANYLAMINO)-BENZOYL-ALPHA-PHENOXY-N-(2-CHLORPHENYL)-ACETAMIDE
1Identification
【Name】
ALPHA-(4-OCTADECANYLAMINO)-BENZOYL-ALPHA-PHENOXY-N-(2-CHLORPHENYL)-ACETAMIDE
【CAS】
【MDL】
MFCD00143574
【English Synonyms】
【Formula】
C39 H53 Cl N2 O3
【MolWeight】
633.312
【Inchi】
InChI=1S/C39H53ClN2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-22-31-41-33-29-27-32(28-30-33)37(43)38(45-34-23-18-17-19-24-34)39(44)42-36-26-21-20-25-35(36)40/h17-21,23-30,38,41H,2-16,22,31H2,1H3,(H,42,44)
【InChIKey】
InChIKey=DEQRLTIYYOTDKR-UHFFFAOYSA-N
【SMILES】
CCCCCCCCCCCCCCCCCCNc1ccc(cc1)C(=O)C(C(=O)Nc2ccccc2Cl)Oc3ccccc3
【MOL File】
ALPHA-(4-OCTADECANYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:12.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ALPHA-(4-OCTADECANYLAMINO)-BENZOYL-ALPHA-PHENOXY-N-(2-CHLORPHENYL)-ACETAMIDE.cml