67528-34-1
AlkaPlorer ID: AK014370
Synonym: 'Dysidenin', '(-)-Dysidenin'
IUPAC Name: (2S,4R)-5,5,5-trichloro-4-methyl-2-[methyl-[(3R)-4,4,4-trichloro-3-methylbutanoyl]amino]-N-[(1R)-1-(1,3-thiazol-2-yl)ethyl]pentanamide
Structure
SMILES: C[C@H](CC(=O)N(C)[C@@H](C[C@@H](C)C(Cl)(Cl)Cl)C(=O)N[C@H](C)C1=NC=CS1)C(Cl)(Cl)Cl
InChI: InChI=1S/C17H23Cl6N3O2S/c1-9(16(18,19)20)7-12(14(28)25-11(3)15-24-5-6-29-15)26(4)13(27)8-10(2)17(21,22)23/h5-6,9-12H,7-8H2,1-4H3,(H,25,28)/t9-,10-,11-,12+/m1/s1
InChIKey: BFVRAKVNXYQMID-KKOKHZNYSA-N
Source
Properties Information
Molecule Weight: 546.1750000000001
TPSA？: 62.3
MolLogP？: 5.940100000000005
Number of H-Donors: 1
Number of H-Acceptors: 4
RingCount: 1
Activities Information
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