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139035-68-0 | Benzamide, 2-methoxy-N-(2-methyl-2H-tetrazol-5-yl)-
CAS No: 139035-68-0 Catalog No: AG001A2A MDL No:
Product Description
Catalog Number:
AG001A2A
Chemical Name:
Benzamide, 2-methoxy-N-(2-methyl-2H-tetrazol-5-yl)-
CAS Number:
139035-68-0
Molecular Formula:
C10H11N5O2
Molecular Weight:
233.2266
IUPAC Name:
2-methoxy-N-(2-methyltetrazol-5-yl)benzamide
InChI:
InChI=1S/C10H11N5O2/c1-15-13-10(12-14-15)11-9(16)7-5-3-4-6-8(7)17-2/h3-6H,1-2H3,(H,11,13,16)
InChI Key:
ZAFSETFRXGZYPR-UHFFFAOYSA-N
SMILES:
COc1ccccc1C(=O)Nc1nnn(n1)C
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.091g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
233.231g/mol
Monoisotopic Mass:
233.091g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
81.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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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