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909207-40-5 | N-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydrobenzo[d]isoxazole-3-carboxamide
CAS No: 909207-40-5 Catalog No: AG00H4PO MDL No:
Product Description
Catalog Number:
AG00H4PO
Chemical Name:
N-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydrobenzo[d]isoxazole-3-carboxamide
CAS Number:
909207-40-5
IUPAC Name:
N-(thiophen-2-ylmethyl)-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
InChI:
InChI=1S/C13H14N2O2S/c16-13(14-8-9-4-3-7-18-9)12-10-5-1-2-6-11(10)17-15-12/h3-4,7H,1-2,5-6,8H2,(H,14,16)
InChI Key:
COZSSXVMJMSTQW-UHFFFAOYSA-N
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.078g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
262.327g/mol
Monoisotopic Mass:
262.078g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
83.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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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