6-bromo-3-pentyl-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
6-bromo-3-pentyl-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
6-bromo-3-pentyl-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K284-0528 |
| Compound Name: | 6-bromo-3-pentyl-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 327.24 |
| Molecular Formula: | C13 H15 Br N2 O S |
| Smiles: | CCCCCN1C(c2cc(ccc2NC1=S)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.608 |
| logD: | 4.5431 |
| logSw: | -4.2692 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.5678 |
| InChI Key: | HZIKACZFOHOVLM-UHFFFAOYSA-N |