5a,6,11a,12-tetrahydro-5a,11a-dimethyl[1,4]benzoxazino[3,2-b][1,4]benzoxazine

AlkaPlorer ID: AK078584

Synonym: None

IUPAC Name: (5aR,11aR)-5a,11a-dimethyl-6,12-dihydro-[1,4]benzoxazino[3,2-b][1,4]benzoxazine

Structure

SMILES: C[C@]12NC3=CC=CC=C3O[C@@]1(C)NC1=CC=CC=C1O2

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InChI: InChI=1S/C16H16N2O2/c1-15-16(2,18-12-8-4-5-9-13(12)19-15)20-14-10-6-3-7-11(14)17-15/h3-10,17-18H,1-2H3/t15-,16-/m1/s1

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InChIKey: MRJVYODCYFNXFB-HZPDHXFCSA-N

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Properties Information

Molecule Weight: 268.316

TPSA: 42.52

MolLogP: 3.4278000000000013

Number of H-Donors: 2

Number of H-Acceptors: 4

RingCount: 4

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information