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383147-41-9 | 4-methoxy-N-[4-(1H-pyrrol-1-yl)phenyl]benzene-1-sulfonamide
CAS No: 383147-41-9 Catalog No: AG00INSV MDL No:MFCD03012001
Product Description
Catalog Number:
AG00INSV
Chemical Name:
4-methoxy-N-[4-(1H-pyrrol-1-yl)phenyl]benzene-1-sulfonamide
CAS Number:
383147-41-9
Molecular Formula:
C17H16N2O3S
Molecular Weight:
328.3855
MDL Number:
MFCD03012001
IUPAC Name:
4-methoxy-N-(4-pyrrol-1-ylphenyl)benzenesulfonamide
InChI:
InChI=1S/C17H16N2O3S/c1-22-16-8-10-17(11-9-16)23(20,21)18-14-4-6-15(7-5-14)19-12-2-3-13-19/h2-13,18H,1H3
InChI Key:
ZOLHTIXDWSGWAP-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)n1cccc1
Properties
Complexity:
455
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.088g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
328.386g/mol
Monoisotopic Mass:
328.088g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
68.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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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