Dictazoline B

AlkaPlorer ID: AK028787

Synonym: ''

IUPAC Name: None

Structure

SMILES: CN1C(=N)N(C)[C@]2(C1=O)C1=C(C[C@@]3(NC(=N)N=C3O)[C@H]2C2=CNC3=CC(Br)=CC=C23)C2=CC=C(Br)C=C2N1

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InChI: InChI=1S/C26H22Br2N8O2/c1-35-22(38)26(36(2)24(35)30)19(16-10-31-17-7-11(27)4-6-14(16)17)25(21(37)33-23(29)34-25)9-15-13-5-3-12(28)8-18(13)32-20(15)26/h3-8,10,19,30-32H,9H2,1-2H3,(H3,29,33,34,37)/t19-,25-,26+/m1/s1

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InChIKey: OYDHIJZSLWXELA-BAEUJYSMSA-N

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Properties Information

Molecule Weight: 638.3240000000001

TPSA: 147.45

MolLogP: 4.281240000000003

Number of H-Donors: 6

Number of H-Acceptors: 3

RingCount: 7

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information