TAN 1030A; N6-(Isopropoxymethyl) 

AlkaPlorer ID: AK314920

Synonym: None

IUPAC Name: None

Structure

SMILES: COC1/C(=N/O)CC2OC1(C)N1C3=CC=CC=C3C3=C4CN(COC(C)C)C(=O)C4=C4C5=CC=CC=C5N2C4=C31

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InChI: InChI=1S/C31H30N4O5/c1-16(2)39-15-33-14-19-24-18-10-6-8-12-22(18)35-28(24)27-25(26(19)30(33)36)17-9-5-7-11-21(17)34(27)23-13-20(32-37)29(38-4)31(35,3)40-23/h5-12,16,23,29,37H,13-15H2,1-4H3/b32-20+

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InChIKey: AAVOQSXFLDIRRH-UZWMFBFFSA-N

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Reference

CAS: 178276-04-5

Properties Information

Molecule Weight: 538.6040000000003

TPSA: 90.45000000000002

MolLogP: 5.691100000000006

Number of H-Donors: 1

Number of H-Acceptors: 8

RingCount: 8

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information