| CAS Number | 748792-97-4 |
| Catalog Number | AG00ICKH |
| Chemical Name | N-[bis(2-chlorophenyl)-1,3-thiazol-2-yl]-2-chloroacetamide |
| IUPAC Name | N-[4,5-bis(2-chlorophenyl)-1,3-thiazol-2-yl]-2-chloroacetamide |
| InChI | InChI=1S/C17H11Cl3N2OS/c18-9-14(23)21-17-22-15(10-5-1-3-7-12(10)19)16(24-17)11-6-2-4-8-13(11)20/h1-8H,9H2,(H,21,22,23) |
| InChI Key | ZGOJJMYIKCZHIF-UHFFFAOYSA-N |
| MDL Number | MFCD03655003 |
| Molecular Formula | C17H11Cl3N2OS |
| Molecular Weight | 397.7060 |
| SMILES | ClCC(=O)Nc1nc(c(s1)c1ccccc1Cl)c1ccccc1Cl |
| Synonyms | N-[bis(2-chlorophenyl)-1,3-thiazol-2-yl]-2-chloroacetamide,
748792-97-4,
N-[4,5-Bis-(2-chloro-phenyl)-thiazol-2-yl]-2-chloro-acetamide,
AC1M5PFC,
AC1Q3TKY,
CTK6H5689,
ZINC3266450,
MFCD03655003,
AKOS000115694,
MCULE-9254349817,
NE20088,
EN300-01952,
N-[4,5-bis(2-chlorophenyl)-1,3-thiazol-2-yl]-2-chloroacetamide,
ZINC03266450,
CID2382941,
|
| Complexity | 442 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 395.966g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 24 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 397.698g/mol |
| Monoisotopic Mass | 395.966g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 70.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 5.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number