methyl 4-{[3-(methylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]carbamoyl}benzoate
Chemical Structure Depiction of
methyl 4-{[3-(methylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]carbamoyl}benzoate
methyl 4-{[3-(methylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]carbamoyl}benzoate
Compound characteristics
| Compound ID: | G839-0068 |
| Compound Name: | methyl 4-{[3-(methylcarbamoyl)-5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl]carbamoyl}benzoate |
| Molecular Weight: | 358.41 |
| Molecular Formula: | C18 H18 N2 O4 S |
| Smiles: | CNC(c1c2CCCc2sc1NC(c1ccc(cc1)C(=O)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6284 |
| logD: | 0.3701 |
| logSw: | -3.0709 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.42 |
| InChI Key: | FIBDUPVIWNBFET-UHFFFAOYSA-N |