ethyl 4-(4-bromophenyl)-2-(3-phenylprop-2-ynamido)thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 4-(4-bromophenyl)-2-(3-phenylprop-2-ynamido)thiophene-3-carboxylate
ethyl 4-(4-bromophenyl)-2-(3-phenylprop-2-ynamido)thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 3237-0548 |
| Compound Name: | ethyl 4-(4-bromophenyl)-2-(3-phenylprop-2-ynamido)thiophene-3-carboxylate |
| Molecular Weight: | 454.34 |
| Molecular Formula: | C22 H16 Br N O3 S |
| Smiles: | CCOC(c1c(csc1NC(C#Cc1ccccc1)=O)c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 6.4288 |
| logD: | 6.4255 |
| logSw: | -5.841 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.393 |
| InChI Key: | VIYZYGGEKVANJN-UHFFFAOYSA-N |