methyl 3-[(pyrrolidine-1-carbothioyl)amino]thiophene-2-carboxylate
Chemical Structure Depiction of
methyl 3-[(pyrrolidine-1-carbothioyl)amino]thiophene-2-carboxylate
methyl 3-[(pyrrolidine-1-carbothioyl)amino]thiophene-2-carboxylate
Compound characteristics
| Compound ID: | C200-1737 |
| Compound Name: | methyl 3-[(pyrrolidine-1-carbothioyl)amino]thiophene-2-carboxylate |
| Molecular Weight: | 270.37 |
| Molecular Formula: | C11 H14 N2 O2 S2 |
| Smiles: | COC(c1c(ccs1)NC(N1CCCC1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6959 |
| logD: | 2.6957 |
| logSw: | -3.04 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.997 |
| InChI Key: | RGDVQQAZHADVDT-UHFFFAOYSA-N |