3-[2-(diethylamino)ethyl]-7-(pyrrolidine-1-carbonyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
3-[2-(diethylamino)ethyl]-7-(pyrrolidine-1-carbonyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
3-[2-(diethylamino)ethyl]-7-(pyrrolidine-1-carbonyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K288-0199 |
| Compound Name: | 3-[2-(diethylamino)ethyl]-7-(pyrrolidine-1-carbonyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 374.5 |
| Molecular Formula: | C19 H26 N4 O2 S |
| Smiles: | CCN(CC)CCN1C(c2ccc(cc2NC1=S)C(N1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2333 |
| logD: | 0.7858 |
| logSw: | -3.0619 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.993 |
| InChI Key: | FZKYWIPFTIAKRF-UHFFFAOYSA-N |