6-bromo-3-(2-phenylethyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
6-bromo-3-(2-phenylethyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
6-bromo-3-(2-phenylethyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K287-0027 |
| Compound Name: | 6-bromo-3-(2-phenylethyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 361.26 |
| Molecular Formula: | C16 H13 Br N2 O S |
| Smiles: | C(CN1C(c2cc(ccc2NC1=S)[Br])=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3981 |
| logD: | 4.231 |
| logSw: | -4.2702 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 27.2963 |
| InChI Key: | QFBSJSQSXGJYTE-UHFFFAOYSA-N |