3-[3-(2,6-dimethylpiperidin-1-yl)propyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
3-[3-(2,6-dimethylpiperidin-1-yl)propyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
3-[3-(2,6-dimethylpiperidin-1-yl)propyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | C270-0428 |
| Compound Name: | 3-[3-(2,6-dimethylpiperidin-1-yl)propyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 331.48 |
| Molecular Formula: | C18 H25 N3 O S |
| Smiles: | CC1CCCC(C)N1CCCN1C(c2ccccc2NC1=S)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3517 |
| logD: | 0.3995 |
| logSw: | -3.769 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.834 |
| InChI Key: | RFFSYBXNBGMVEV-UHFFFAOYSA-N |