1-{5-[(prop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(thiophen-2-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Chemical Structure Depiction of
1-{5-[(prop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(thiophen-2-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
1-{5-[(prop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(thiophen-2-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione
Compound characteristics
| Compound ID: | 8015-3712 |
| Compound Name: | 1-{5-[(prop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(thiophen-2-yl)-4,6,7,8-tetrahydroquinoline-2,5(1H,3H)-dione |
| Molecular Weight: | 403.54 |
| Molecular Formula: | C18 H17 N3 O2 S3 |
| Smiles: | C=CCSc1nnc(N2C3CCCC(C=3C(CC2=O)c2cccs2)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1908 |
| logD: | 3.1908 |
| logSw: | -3.4237 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.284 |
| InChI Key: | XJRGJEYFYMSDAI-LLVKDONJSA-N |