| CAS Number | 313524-20-8 |
| Catalog Number | AG01EUVH(AGN-PC-3H47OK) |
| Chemical Name | 2-Amino-N-phenylbenzo[d]thiazole-6-carboxamide |
| IUPAC Name | 2-amino-N-phenyl-1,3-benzothiazole-6-carboxamide |
| InChI | InChI=1S/C14H11N3OS/c15-14-17-11-7-6-9(8-12(11)19-14)13(18)16-10-4-2-1-3-5-10/h1-8H,(H2,15,17)(H,16,18) |
| InChI Key | HWMYOGNXEBTENC-UHFFFAOYSA-N |
| MDL Number | MFCD00608285 |
| Molecular Formula | C14H11N3OS |
| Molecular Weight | 269.3216 |
| SMILES | C1(N)SC2C(=CC=C(C=2)C(=O)NC2C=CC=CC=2)N=1 |
| Synonyms | 2-Amino-benzothiazole-6-carboxylic acid phenylamide,
313524-20-8,
2-Amino-N-phenylbenzo[d]thiazole-6-carboxamide,
SMR000012319,
AC1LDA0D,
Oprea1_199561,
MLS000034150,
CHEMBL1607390,
HMS2156A05,
HMS3322B02,
ZINC241717,
AKOS001572551,
BAS 03421288,
2-amino-benzothiazole-6-carboxylic acidphenylamide,
2-amino-N-phenyl-1,3-benzothiazole-6-carboxamide,
2-Aminobenzothiazole-6-carboxylic acid phenylamide,
SR-01000393889,
SR-01000393889-1,
CID644786,
|
| Complexity | 333 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 269.062g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 269.322g/mol |
| Monoisotopic Mass | 269.062g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 96.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number