N-[(3-chlorophenyl)methyl]-3-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)propanamide
Chemical Structure Depiction of
N-[(3-chlorophenyl)methyl]-3-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)propanamide
N-[(3-chlorophenyl)methyl]-3-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)propanamide
Compound characteristics
| Compound ID: | K284-2475 |
| Compound Name: | N-[(3-chlorophenyl)methyl]-3-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)propanamide |
| Molecular Weight: | 373.86 |
| Molecular Formula: | C18 H16 Cl N3 O2 S |
| Smiles: | C(CN1C(c2ccccc2NC1=S)=O)C(NCc1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2992 |
| logD: | 3.2978 |
| logSw: | -3.8892 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.768 |
| InChI Key: | YSMMOFDMQDOISZ-UHFFFAOYSA-N |