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Home > Pyridines > 848373-17-1
848373-17-1 | 4-methyl-3-(morpholine-4-sulfonyl)-N-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]benzamide
CAS No: 848373-17-1 Catalog No: AG01BHVC MDL No:MFCD07321219
Product Description
Catalog Number:
AG01BHVC
Chemical Name:
4-methyl-3-(morpholine-4-sulfonyl)-N-[4-(pyridin-2-yl)-1,3-thiazol-2-yl]benzamide
CAS Number:
848373-17-1
Molecular Formula:
C20H20N4O4S2
Molecular Weight:
444.5272
MDL Number:
MFCD07321219
IUPAC Name:
4-methyl-3-morpholin-4-ylsulfonyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
InChI:
InChI=1S/C20H20N4O4S2/c1-14-5-6-15(12-18(14)30(26,27)24-8-10-28-11-9-24)19(25)23-20-22-17(13-29-20)16-4-2-3-7-21-16/h2-7,12-13H,8-11H2,1H3,(H,22,23,25)
InChI Key:
ICXBYAWXQRDDNK-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(c(c1)S(=O)(=O)N1CCOCC1)C)Nc1scc(n1)c1ccccn1
Properties
Complexity:
695
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
444.093g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
444.524g/mol
Monoisotopic Mass:
444.093g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
138A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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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