| CAS Number | 1391737-01-1 |
| Catalog Number | AG01ENNU(AGN-PC-3H460H) |
| Chemical Name | N-Cyclopropyl-N-(4-methyl-2-thiazolyl)-2-[(6-phenyl-3-pyridazinyl)thio]acetamide |
| IUPAC Name | N-cyclopropyl-N-(4-methyl-1,3-thiazol-2-yl)-2-(6-phenylpyridazin-3-yl)sulfanylacetamide |
| InChI | InChI=1S/C19H18N4OS2/c1-13-11-26-19(20-13)23(15-7-8-15)18(24)12-25-17-10-9-16(21-22-17)14-5-3-2-4-6-14/h2-6,9-11,15H,7-8,12H2,1H3 |
| InChI Key | DPONSKCACOZTGN-UHFFFAOYSA-N |
| MDL Number | MFCD30182240 |
| Molecular Formula | C19H18N4OS2 |
| Molecular Weight | 382.5024 |
| SMILES | O=C(N(C1CC1)C2=NC(C)=CS2)CSC3=NN=C(C4=CC=CC=C4)C=C3 |
| Synonyms | 1391737-01-1,
CHEMBL2048855,
VU 0463271,
VU0463271,
N-Cyclopropyl-N-(4-methyl-2-thiazolyl)-2-[(6-phenyl-3-pyridazinyl)thio]acetamide,
n-cyclopropyl-n-(4-methylthiazol-2-yl)-2-(6-phenylpyridazin-3-ylsulfanyl)acetamide,
SCHEMBL20240422,
BDBM50387290,
ZINC84669832,
AKOS025142018,
SB19237,
NCGC00387186-01,
HY-110110,
CS-0032962,
VU-0463271,
VU0463271 (Synonyms: N-Cyclopropyl-N-(4-methyl-2-thiazolyl)-2-[(6-phenyl-3-pyridazinyl)thio]acetamide),
DPONSKCACOZTGN-UHFFFAOYSA-N,
n-cyclopropyl-n-(4-methyl-thiazol-2-yl)-2-(6-phenyl-pyridazin-3-ylsulfanyl)acetamide,
|
| Complexity | 484 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 382.092g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 26 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 382.5g/mol |
| Monoisotopic Mass | 382.092g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 113A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number