6-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-pentylhexanamide
Chemical Structure Depiction of
6-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-pentylhexanamide
6-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-pentylhexanamide
Compound characteristics
| Compound ID: | K284-0901 |
| Compound Name: | 6-(4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-pentylhexanamide |
| Molecular Weight: | 361.5 |
| Molecular Formula: | C19 H27 N3 O2 S |
| Smiles: | CCCCCNC(CCCCCN1C(c2ccccc2NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4414 |
| logD: | 3.4403 |
| logSw: | -3.7291 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.881 |
| InChI Key: | RMLUUPONOFYONS-UHFFFAOYSA-N |