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Home > Indoles and Oxindole > 1032073-17-8
1032073-17-8 | 1-[(3,5-DIMETHYL-1H-PYRAZOL-4-YL)SULFONYL]INDOLINE HYDROCHLORIDE
CAS No: 1032073-17-8 Catalog No: AG019OKX MDL No:MFCD07339311
Product Description
Catalog Number:
AG019OKX
Chemical Name:
1-[(3,5-DIMETHYL-1H-PYRAZOL-4-YL)SULFONYL]INDOLINE HYDROCHLORIDE
CAS Number:
1032073-17-8
Molecular Formula:
C13H16ClN3O2S
Molecular Weight:
313.8030
MDL Number:
MFCD07339311
IUPAC Name:
1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]-2,3-dihydroindole;hydrochloride
InChI:
InChI=1S/C13H15N3O2S.ClH/c1-9-13(10(2)15-14-9)19(17,18)16-8-7-11-5-3-4-6-12(11)16;/h3-6H,7-8H2,1-2H3,(H,14,15);1H
InChI Key:
CVYAFGKJJFOHJQ-UHFFFAOYSA-N
SMILES:
Cc1[nH]nc(c1S(=O)(=O)N1CCc2c1cccc2)C.Cl
Properties
Complexity:
434
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.065g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
313.8g/mol
Monoisotopic Mass:
313.065g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
74.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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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