N-[2-(4-chlorophenyl)ethyl]-6-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
Chemical Structure Depiction of
N-[2-(4-chlorophenyl)ethyl]-6-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
N-[2-(4-chlorophenyl)ethyl]-6-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
Compound characteristics
| Compound ID: | K284-1149 |
| Compound Name: | N-[2-(4-chlorophenyl)ethyl]-6-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)hexanamide |
| Molecular Weight: | 429.97 |
| Molecular Formula: | C22 H24 Cl N3 O2 S |
| Smiles: | C(CCC(NCCc1ccc(cc1)[Cl])=O)CCN1C(c2ccccc2NC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7282 |
| logD: | 3.7271 |
| logSw: | -4.5066 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.609 |
| InChI Key: | SOMPKFDHBDNQLN-UHFFFAOYSA-N |