3-[4-(3-methylpiperidine-1-carbonyl)phenyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
3-[4-(3-methylpiperidine-1-carbonyl)phenyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
3-[4-(3-methylpiperidine-1-carbonyl)phenyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K288-0226 |
| Compound Name: | 3-[4-(3-methylpiperidine-1-carbonyl)phenyl]-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 379.48 |
| Molecular Formula: | C21 H21 N3 O2 S |
| Smiles: | CC1CCCN(C1)C(c1ccc(cc1)N1C(c2ccccc2NC1=S)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1154 |
| logD: | 3.1096 |
| logSw: | -3.5701 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.288 |
| InChI Key: | VNKIFKVSLLTICO-AWEZNQCLSA-N |