N-[(3-chlorophenyl)methyl]-6-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
Chemical Structure Depiction of
N-[(3-chlorophenyl)methyl]-6-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
N-[(3-chlorophenyl)methyl]-6-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)hexanamide
Compound characteristics
| Compound ID: | K284-1424 |
| Compound Name: | N-[(3-chlorophenyl)methyl]-6-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)hexanamide |
| Molecular Weight: | 415.94 |
| Molecular Formula: | C21 H22 Cl N3 O2 S |
| Smiles: | C(CCC(NCc1cccc(c1)[Cl])=O)CCN1C(c2ccccc2NC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0561 |
| logD: | 4.055 |
| logSw: | -4.3417 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.768 |
| InChI Key: | YRYHUKUPWHDTEB-UHFFFAOYSA-N |