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221014-03-5 | 3-(5-Methoxy-1H-benzoimidazol-2-ylamino)-propan-1-ol
CAS No: 221014-03-5 Catalog No: AG01F8LP MDL No:
Product Description
Catalog Number:
AG01F8LP
Chemical Name:
3-(5-Methoxy-1H-benzoimidazol-2-ylamino)-propan-1-ol
CAS Number:
221014-03-5
Molecular Formula:
C11H15N3O2
Molecular Weight:
221.2557
IUPAC Name:
3-[(6-methoxy-1H-benzimidazol-2-yl)amino]propan-1-ol
InChI:
InChI=1S/C11H15N3O2/c1-16-8-3-4-9-10(7-8)14-11(13-9)12-5-2-6-15/h3-4,7,15H,2,5-6H2,1H3,(H2,12,13,14)
InChI Key:
JLPBLFOJWKMBRM-UHFFFAOYSA-N
SMILES:
OCCCNc1nc2c([nH]1)ccc(c2)OC
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.116g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
221.26g/mol
Monoisotopic Mass:
221.116g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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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