N-[(4-chlorophenyl)methyl]-2-{2-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]-1,3-thiazol-4-yl}acetamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-{2-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]-1,3-thiazol-4-yl}acetamide
N-[(4-chlorophenyl)methyl]-2-{2-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]-1,3-thiazol-4-yl}acetamide
Compound characteristics
| Compound ID: | K297-1117 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-2-{2-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]-1,3-thiazol-4-yl}acetamide |
| Molecular Weight: | 441.96 |
| Molecular Formula: | C20 H16 Cl N5 O S2 |
| Smiles: | C(C(NCc1ccc(cc1)[Cl])=O)c1csc(NC2c3ccccc3NC(N=2)=S)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.2252 |
| logD: | 1.5706 |
| logSw: | -4.7423 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 64.481 |
| InChI Key: | ICULCQQZFHRFJH-UHFFFAOYSA-N |