methyl 3-(3-chlorobenzamido)-4,5-dihydrothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-(3-chlorobenzamido)-4,5-dihydrothiophene-2-carboxylate
methyl 3-(3-chlorobenzamido)-4,5-dihydrothiophene-2-carboxylate
Compound characteristics
| Compound ID: | 2513-1272 |
| Compound Name: | methyl 3-(3-chlorobenzamido)-4,5-dihydrothiophene-2-carboxylate |
| Molecular Weight: | 297.76 |
| Molecular Formula: | C13 H12 Cl N O3 S |
| Smiles: | COC(C1=C(CCS1)NC(c1cccc(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6002 |
| logD: | -1.0309 |
| logSw: | -3.456 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.871 |
| InChI Key: | OZWSSPFQAFRTES-UHFFFAOYSA-N |