3-(2-{[2-(3,4-diethoxyphenyl)ethyl]amino}prop-1-en-1-yl)-N-(4-methoxyphenyl)-1,2,4-thiadiazol-5-amine
Chemical Structure Depiction of
3-(2-{[2-(3,4-diethoxyphenyl)ethyl]amino}prop-1-en-1-yl)-N-(4-methoxyphenyl)-1,2,4-thiadiazol-5-amine
3-(2-{[2-(3,4-diethoxyphenyl)ethyl]amino}prop-1-en-1-yl)-N-(4-methoxyphenyl)-1,2,4-thiadiazol-5-amine
Compound characteristics
| Compound ID: | C120-0031 |
| Compound Name: | 3-(2-{[2-(3,4-diethoxyphenyl)ethyl]amino}prop-1-en-1-yl)-N-(4-methoxyphenyl)-1,2,4-thiadiazol-5-amine |
| Molecular Weight: | 454.59 |
| Molecular Formula: | C24 H30 N4 O3 S |
| Smiles: | CCOc1ccc(CCNC(\C)=C\c2nc(Nc3ccc(cc3)OC)sn2)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 4.7648 |
| logD: | 4.7621 |
| logSw: | -4.5025 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.685 |
| InChI Key: | NQMMAIGHQZEZSB-UHFFFAOYSA-N |