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130839-21-3 | 1H-Indol-5-ol, 3-(2-aminoethyl)-4-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]-
CAS No: 130839-21-3 Catalog No: AG000V02 MDL No:
Product Description
Catalog Number:
AG000V02
Chemical Name:
1H-Indol-5-ol, 3-(2-aminoethyl)-4-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]-
CAS Number:
130839-21-3
Molecular Formula:
C20H22N4O2
Molecular Weight:
350.4143
IUPAC Name:
3-(2-aminoethyl)-4-[[3-(2-aminoethyl)-1H-indol-5-yl]oxy]-1H-indol-5-ol
InChI:
InChI=1S/C20H22N4O2/c21-7-5-12-10-23-16-2-1-14(9-15(12)16)26-20-18(25)4-3-17-19(20)13(6-8-22)11-24-17/h1-4,9-11,23-25H,5-8,21-22H2
InChI Key:
ZRRSDPPRVSCKQR-UHFFFAOYSA-N
SMILES:
NCCc1c[nH]c2c1cc(cc2)Oc1c(O)ccc2c1c(CCN)c[nH]2
Properties
Complexity:
465
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.174g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
350.422g/mol
Monoisotopic Mass:
350.174g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
113A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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