6-bromo-3-[4-(morpholin-4-yl)-4-oxobutyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
6-bromo-3-[4-(morpholin-4-yl)-4-oxobutyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
6-bromo-3-[4-(morpholin-4-yl)-4-oxobutyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K284-4070 |
| Compound Name: | 6-bromo-3-[4-(morpholin-4-yl)-4-oxobutyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 412.3 |
| Molecular Formula: | C16 H18 Br N3 O3 S |
| Smiles: | C(CC(N1CCOCC1)=O)CN1C(c2cc(ccc2NC1=S)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 1.7352 |
| logD: | 1.6703 |
| logSw: | -2.6489 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.597 |
| InChI Key: | PLSFXLNEQDBPAM-UHFFFAOYSA-N |