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Home > Indoles and Oxindole > 10513-98-1
10513-98-1 | 1H-Isoindole-1,3(2H)-dione,2,2'-(1,6-hexanediyl)bis-
CAS No: 10513-98-1 Catalog No: AG007X2L MDL No:
Product Description
Catalog Number:
AG007X2L
Chemical Name:
1H-Isoindole-1,3(2H)-dione,2,2'-(1,6-hexanediyl)bis-
CAS Number:
10513-98-1
Molecular Formula:
C22H20N2O4
Molecular Weight:
376.4052
IUPAC Name:
2-[6-(1,3-dioxoisoindol-2-yl)hexyl]isoindole-1,3-dione
InChI:
InChI=1S/C22H20N2O4/c25-19-15-9-3-4-10-16(15)20(26)23(19)13-7-1-2-8-14-24-21(27)17-11-5-6-12-18(17)22(24)28/h3-6,9-12H,1-2,7-8,13-14H2
InChI Key:
MJYXMZHGVMGKLG-UHFFFAOYSA-N
SMILES:
O=C1N(CCCCCCN2C(=O)c3c(C2=O)cccc3)C(=O)c2c1cccc2
NSC Number:
76816
Properties
Complexity:
557
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
376.142g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
376.412g/mol
Monoisotopic Mass:
376.142g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
74.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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