3-[2-(cyclooctylamino)prop-1-en-1-yl]-N-(3,4-dichlorophenyl)-1,2,4-thiadiazol-5-amine
Chemical Structure Depiction of
3-[2-(cyclooctylamino)prop-1-en-1-yl]-N-(3,4-dichlorophenyl)-1,2,4-thiadiazol-5-amine
3-[2-(cyclooctylamino)prop-1-en-1-yl]-N-(3,4-dichlorophenyl)-1,2,4-thiadiazol-5-amine
Compound characteristics
| Compound ID: | C120-0044 |
| Compound Name: | 3-[2-(cyclooctylamino)prop-1-en-1-yl]-N-(3,4-dichlorophenyl)-1,2,4-thiadiazol-5-amine |
| Molecular Weight: | 411.39 |
| Molecular Formula: | C19 H24 Cl2 N4 S |
| Smiles: | C/C(=C\c1nc(Nc2ccc(c(c2)[Cl])[Cl])sn1)NC1CCCCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 7.6567 |
| logD: | 7.5968 |
| logSw: | -6.7114 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 39.936 |
| InChI Key: | QXSAKXYSIWMMPC-UHFFFAOYSA-N |