methyl 4-(4-cyclohexylphenyl)-2-(3-phenylprop-2-ynamido)thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 4-(4-cyclohexylphenyl)-2-(3-phenylprop-2-ynamido)thiophene-3-carboxylate
methyl 4-(4-cyclohexylphenyl)-2-(3-phenylprop-2-ynamido)thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y200-1840 |
| Compound Name: | methyl 4-(4-cyclohexylphenyl)-2-(3-phenylprop-2-ynamido)thiophene-3-carboxylate |
| Molecular Weight: | 443.56 |
| Molecular Formula: | C27 H25 N O3 S |
| Smiles: | COC(c1c(csc1NC(C#Cc1ccccc1)=O)c1ccc(cc1)C1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.5561 |
| logD: | 7.5529 |
| logSw: | -5.8103 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.734 |
| InChI Key: | IWFKAMGOHJBITP-UHFFFAOYSA-N |