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1020719-25-8 | 2-Propanol, 1-(9H-carbazol-4-yloxy)-3-[[2-[2-(methoxy-d3)phenoxy]ethyl]amino]-
CAS No: 1020719-25-8 Catalog No: AG0006JR MDL No:
Product Description
Catalog Number:
AG0006JR
Chemical Name:
2-Propanol, 1-(9H-carbazol-4-yloxy)-3-[[2-[2-(methoxy-d3)phenoxy]ethyl]amino]-
CAS Number:
1020719-25-8
Molecular Formula:
C24H23D3N2O4
Molecular Weight:
409.4927
IUPAC Name:
1-(9H-carbazol-4-yloxy)-3-[2-[2-(trideuteriomethoxy)phenoxy]ethylamino]propan-2-ol
InChI:
InChI=1S/C24H26N2O4/c1-28-21-10-4-5-11-22(21)29-14-13-25-15-17(27)16-30-23-12-6-9-20-24(23)18-7-2-3-8-19(18)26-20/h2-12,17,25-27H,13-16H2,1H3/i1D3
InChI Key:
OGHNVEJMJSYVRP-FIBGUPNXSA-N
SMILES:
OC(COc1cccc2c1c1ccccc1[nH]2)CNCCOc1ccccc1OC([2H])([2H])[2H]
Properties
Complexity:
508
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
409.208g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
3
Molecular Weight:
409.5g/mol
Monoisotopic Mass:
409.208g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
75.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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