| CAS Number | 1000932-79-5 |
| Catalog Number | AG019LG5 |
| Chemical Name | 2-oxo-1-propyl-2,3-dihydro-1H-1,3-benzodiazole-5-sulfonamide |
| IUPAC Name | 2-oxo-1-propyl-3H-benzimidazole-5-sulfonamide |
| InChI | InChI=1S/C10H13N3O3S/c1-2-5-13-9-4-3-7(17(11,15)16)6-8(9)12-10(13)14/h3-4,6H,2,5H2,1H3,(H,12,14)(H2,11,15,16) |
| InChI Key | GLSSKTDYKDTABW-UHFFFAOYSA-N |
| MDL Number | MFCD09971406 |
| Molecular Formula | C10H13N3O3S |
| Molecular Weight | 255.2935 |
| SMILES | CCCN1C2=C(C=C(S(N)(=O)=O)C=C2)NC1=O |
| Synonyms | 2-oxo-1-propyl-2,3-dihydro-1H-1,3-benzodiazole-5-sulfonamide,
1000932-79-5,
2-oxo-1-propyl-2,3-dihydro-1H-benzimidazole-5-sulfonamide,
AC1Q2XU8,
SPR_10,
BDBM36006,
CTK6E4372,
ZINC20281983,
AKOS034184829,
MCULE-2243668139,
NE33830,
EN300-31156,
Z324553188,
|
| Complexity | 404 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 255.068g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 255.292g/mol |
| Monoisotopic Mass | 255.068g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 101A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number