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331434-23-2

331434-23-2 | N-(4H-1,2,4-triazol-4-yl)naphthalene-2-sulfonamide

CAS No: 331434-23-2 Catalog No: AG00IQ84 MDL No:MFCD00750833

Product Description

Catalog Number:
AG00IQ84
Chemical Name:
N-(4H-1,2,4-triazol-4-yl)naphthalene-2-sulfonamide
CAS Number:
331434-23-2
Molecular Formula:
C12H10N4O2S
Molecular Weight:
274.2984
MDL Number:
MFCD00750833
IUPAC Name:
N-(1,2,4-triazol-4-yl)naphthalene-2-sulfonamide
InChI:
InChI=1S/C12H10N4O2S/c17-19(18,15-16-8-13-14-9-16)12-6-5-10-3-1-2-4-11(10)7-12/h1-9,15H
InChI Key:
RSCHPAPXQXYYGC-UHFFFAOYSA-N
SMILES:
O=S(=O)(c1ccc2c(c1)cccc2)Nn1cnnc1

Properties

Complexity:
402  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.052g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
274.298g/mol
Monoisotopic Mass:
274.052g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
85.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  

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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