N-{3-[ethyl(3-methylphenyl)amino]propyl}-4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)benzamide
Chemical Structure Depiction of
N-{3-[ethyl(3-methylphenyl)amino]propyl}-4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)benzamide
N-{3-[ethyl(3-methylphenyl)amino]propyl}-4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)benzamide
Compound characteristics
| Compound ID: | K284-4328 |
| Compound Name: | N-{3-[ethyl(3-methylphenyl)amino]propyl}-4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)benzamide |
| Molecular Weight: | 472.61 |
| Molecular Formula: | C27 H28 N4 O2 S |
| Smiles: | CCN(CCCNC(c1ccc(cc1)N1C(c2ccccc2NC1=S)=O)=O)c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.5137 |
| logD: | 4.4795 |
| logSw: | -4.1236 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.951 |
| InChI Key: | RCQLCKZXWHMZEV-UHFFFAOYSA-N |