2-(4-ethylpiperazin-1-yl)-6-isothiocyanato-4-methylquinoline
Chemical Structure Depiction of
2-(4-ethylpiperazin-1-yl)-6-isothiocyanato-4-methylquinoline
2-(4-ethylpiperazin-1-yl)-6-isothiocyanato-4-methylquinoline
Compound characteristics
| Compound ID: | C066-2571 |
| Compound Name: | 2-(4-ethylpiperazin-1-yl)-6-isothiocyanato-4-methylquinoline |
| Molecular Weight: | 312.43 |
| Molecular Formula: | C17 H20 N4 S |
| Smiles: | CCN1CCN(CC1)c1cc(C)c2cc(ccc2n1)N=C=S |
| Stereo: | ACHIRAL |
| logP: | 5.1211 |
| logD: | 4.4336 |
| logSw: | -5.1585 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 23.7321 |
| InChI Key: | YWLIDVCDRAAPRE-UHFFFAOYSA-N |