4-({1-[4-(ethoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)-2-methoxyphenyl thiophene-2-carboxylate
Chemical Structure Depiction of
4-({1-[4-(ethoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)-2-methoxyphenyl thiophene-2-carboxylate
4-({1-[4-(ethoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)-2-methoxyphenyl thiophene-2-carboxylate
Compound characteristics
| Compound ID: | 4489-8877 |
| Compound Name: | 4-({1-[4-(ethoxycarbonyl)phenyl]-3,5-dioxopyrazolidin-4-ylidene}methyl)-2-methoxyphenyl thiophene-2-carboxylate |
| Molecular Weight: | 492.51 |
| Molecular Formula: | C25 H20 N2 O7 S |
| Smiles: | CCOC(c1ccc(cc1)N1C(C(=C/c2ccc(c(c2)OC)OC(c2cccs2)=O)\C(N1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0747 |
| logD: | 3.9915 |
| logSw: | -4.3654 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.627 |
| InChI Key: | MFSXOXMBHVUGLT-UHFFFAOYSA-N |