| CAS Number | 853725-36-7 |
| Catalog Number | AG00IDNA(AGN-PC-0KZ27Y) |
| Chemical Name | 2-chloro-N-[5-(diethylsulfamoyl)-2-methoxyphenyl]acetamide |
| IUPAC Name | 2-chloro-N-[5-(diethylsulfamoyl)-2-methoxyphenyl]acetamide |
| InChI | InChI=1S/C13H19ClN2O4S/c1-4-16(5-2)21(18,19)10-6-7-12(20-3)11(8-10)15-13(17)9-14/h6-8H,4-5,9H2,1-3H3,(H,15,17) |
| InChI Key | BISJRGFZKYGDPM-UHFFFAOYSA-N |
| MDL Number | MFCD06655056 |
| Molecular Formula | C13H19ClN2O4S |
| Molecular Weight | 334.8190 |
| SMILES | CCN(S(C1=CC(NC(CCl)=O)=C(OC)C=C1)(=O)=O)CC |
| Synonyms | 853725-36-7,
2-chloro-N-[5-(diethylsulfamoyl)-2-methoxyphenyl]acetamide,
2-chloro-N-{5-[(diethylamino)sulfonyl]-2-methoxyphenyl}acetamide,
2-Chloro-n-(5-[(diethylamino)sulfonyl]-2-methoxyphenyl)acetamide,
AC1MVZ5U,
AC1Q2ZHK,
CTK6E8644,
ZINC3888148,
MFCD06655056,
AKOS001115833,
MCULE-2233169165,
NE23001,
EN300-10501,
ZINC03888148,
CID3715852,
|
| Complexity | 434 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 334.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 334.815g/mol |
| Monoisotopic Mass | 334.075g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 84.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number