N-[2-(4-chlorophenyl)ethyl]-2-{2-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]-1,3-thiazol-4-yl}acetamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-2-{2-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]-1,3-thiazol-4-yl}acetamide
N-[2-(4-chlorophenyl)ethyl]-2-{2-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]-1,3-thiazol-4-yl}acetamide
Compound characteristics
| Compound ID: | K297-1125 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-2-{2-[(2-sulfanylidene-1,2-dihydroquinazolin-4-yl)amino]-1,3-thiazol-4-yl}acetamide |
| Molecular Weight: | 455.99 |
| Molecular Formula: | C21 H18 Cl N5 O S2 |
| Smiles: | C(CNC(Cc1csc(NC2c3ccccc3NC(N=2)=S)n1)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.9999 |
| logD: | 1.3453 |
| logSw: | -4.6677 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 64.323 |
| InChI Key: | XRBZTQNZUHTZQC-UHFFFAOYSA-N |