3-[2-(cyclohex-1-en-1-yl)ethyl]-6,7-dimethoxy-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
3-[2-(cyclohex-1-en-1-yl)ethyl]-6,7-dimethoxy-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
3-[2-(cyclohex-1-en-1-yl)ethyl]-6,7-dimethoxy-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K287-0105 |
| Compound Name: | 3-[2-(cyclohex-1-en-1-yl)ethyl]-6,7-dimethoxy-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 346.45 |
| Molecular Formula: | C18 H22 N2 O3 S |
| Smiles: | COc1cc2C(N(CCC3CCCCC=3)C(Nc2cc1OC)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3947 |
| logD: | 3.3678 |
| logSw: | -3.7348 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.749 |
| InChI Key: | FIBFYPXKMSYKFM-UHFFFAOYSA-N |