InChI=1S/C33H38F3N7O11/c1-15(2)8-22(39-16(3)44)31(52)41-21(6-7-26(45)46)29(50)42-23(9-18-13-37-14-38-18)32(53)43-24(12-27(47)48)30(51)40-17-4-5-19-20(33(34,35)36)11-28(49)54-25(19)10-17/h4-5,10-11,13-15,21-24H,6-9,12H2,1-3H3,(H,37,38)(H,39,44)(H,40,51)(H,41,52)(H,42,50)(H,43,53)(H,45,46)(H,47,48)/t21-,22-,23-,24-/m0/s1

【InChIKey】

InChIKey=HULKIXRFKRCRHD-ZJZGAYNASA-N

【SMILES】

CC(C)C[C@@H](C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(=O)O)C(=O)Nc2ccc3c(cc(=O)oc3c2)C(F)(F)F)NC(=O)C

【MOL File】

AC-LEHD-AFC.mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:8

H bond acceptor:18

XLogP3:-1.0

Bulk/Fine:F

3Material Safety Data Sheet(MSDS)

【WGK Germany】

4CML File

AC-LEHD-AFC.cml

Quick Release

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210345-03-2 AC-LEHD-AFC

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】