methyl 3-(4-tert-butylbenzamido)-4,5-dihydrothiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-(4-tert-butylbenzamido)-4,5-dihydrothiophene-2-carboxylate
methyl 3-(4-tert-butylbenzamido)-4,5-dihydrothiophene-2-carboxylate
Compound characteristics
| Compound ID: | 2513-1292 |
| Compound Name: | methyl 3-(4-tert-butylbenzamido)-4,5-dihydrothiophene-2-carboxylate |
| Molecular Weight: | 319.42 |
| Molecular Formula: | C17 H21 N O3 S |
| Smiles: | CC(C)(C)c1ccc(cc1)C(NC1CCSC=1C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7319 |
| logD: | 0.8984 |
| logSw: | -3.9883 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.871 |
| InChI Key: | NWIZGIFSONCWDY-UHFFFAOYSA-N |