3-(2-{[2-(3,4-diethoxyphenyl)ethyl]amino}prop-1-en-1-yl)-N-phenyl-1,2,4-thiadiazol-5-amine
Chemical Structure Depiction of
3-(2-{[2-(3,4-diethoxyphenyl)ethyl]amino}prop-1-en-1-yl)-N-phenyl-1,2,4-thiadiazol-5-amine
3-(2-{[2-(3,4-diethoxyphenyl)ethyl]amino}prop-1-en-1-yl)-N-phenyl-1,2,4-thiadiazol-5-amine
Compound characteristics
| Compound ID: | C120-0062 |
| Compound Name: | 3-(2-{[2-(3,4-diethoxyphenyl)ethyl]amino}prop-1-en-1-yl)-N-phenyl-1,2,4-thiadiazol-5-amine |
| Molecular Weight: | 424.56 |
| Molecular Formula: | C23 H28 N4 O2 S |
| Smiles: | CCOc1ccc(CCNC(\C)=C\c2nc(Nc3ccccc3)sn2)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 4.5907 |
| logD: | 4.588 |
| logSw: | -4.3807 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.141 |
| InChI Key: | IMJAXVWPCYRYDA-UHFFFAOYSA-N |