2-(3-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-4-methoxyphenyl)-3-[(furan-2-yl)methyl]-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
2-(3-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-4-methoxyphenyl)-3-[(furan-2-yl)methyl]-2,3-dihydroquinazolin-4(1H)-one
2-(3-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-4-methoxyphenyl)-3-[(furan-2-yl)methyl]-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | 4333-7003 |
| Compound Name: | 2-(3-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}-4-methoxyphenyl)-3-[(furan-2-yl)methyl]-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 513.64 |
| Molecular Formula: | C28 H23 N3 O3 S2 |
| Smiles: | COc1ccc(cc1CSc1nc2ccccc2s1)C1Nc2ccccc2C(N1Cc1ccco1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5756 |
| logD: | 6.5756 |
| logSw: | -5.7192 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.532 |
| InChI Key: | AIRUWUSKOAAXNA-SANMLTNESA-N |