| CAS Number | 97437-97-3 |
| Catalog Number | AG01DFIY(AGN-PC-0MQ54G) |
| Chemical Name | 4-Chloro-N-(2,5-dimethylphenyl)-3-sulfamoylbenzamide |
| IUPAC Name | 4-chloro-N-(2,5-dimethylphenyl)-3-sulfamoylbenzamide |
| InChI | InChI=1S/C15H15ClN2O3S/c1-9-3-4-10(2)13(7-9)18-15(19)11-5-6-12(16)14(8-11)22(17,20)21/h3-8H,1-2H3,(H,18,19)(H2,17,20,21) |
| InChI Key | ZYADNDOMPSFJLJ-UHFFFAOYSA-N |
| MDL Number | MFCD28098792 |
| Molecular Formula | C15H15ClN2O3S |
| Molecular Weight | 338.8092 |
| SMILES | Cc1ccc(c(c1)NC(=O)c1ccc(c(c1)S(=O)(=O)N)Cl)C |
| Synonyms | 4-chloro-N-(2,5-dimethylphenyl)-3-sulfamoylbenzamide,
97437-97-3,
ZINC8180651,
MFCD28098792,
AKOS034159569,
ACN-043234,
CS-0061290,
Z31403696,
ZINC08180651,
CID9314092,
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| Complexity | 505 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 338.049g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 22 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 338.806g/mol |
| Monoisotopic Mass | 338.049g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 97.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
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Certificate of Analysis
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