3-(3-methoxypropyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
3-(3-methoxypropyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
3-(3-methoxypropyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K287-0216 |
| Compound Name: | 3-(3-methoxypropyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 250.32 |
| Molecular Formula: | C12 H14 N2 O2 S |
| Smiles: | COCCCN1C(c2ccccc2NC1=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0514 |
| logD: | 2.0503 |
| logSw: | -2.9469 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.91 |
| InChI Key: | KMPHWZNAXDTNMH-UHFFFAOYSA-N |