2-[4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)phenyl]-N-pentylacetamide
Chemical Structure Depiction of
2-[4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)phenyl]-N-pentylacetamide
2-[4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)phenyl]-N-pentylacetamide
Compound characteristics
| Compound ID: | K284-7564 |
| Compound Name: | 2-[4-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)phenyl]-N-pentylacetamide |
| Molecular Weight: | 381.5 |
| Molecular Formula: | C21 H23 N3 O2 S |
| Smiles: | CCCCCNC(Cc1ccc(cc1)N1C(c2ccccc2NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3329 |
| logD: | 3.3271 |
| logSw: | -3.747 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.019 |
| InChI Key: | YXECTVWNNZJBDG-UHFFFAOYSA-N |