N-{4-[5-(3,4-dimethoxyphenyl)-1H-1,2,3-triazol-1-yl]phenyl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{4-[5-(3,4-dimethoxyphenyl)-1H-1,2,3-triazol-1-yl]phenyl}thiophene-2-carboxamide
N-{4-[5-(3,4-dimethoxyphenyl)-1H-1,2,3-triazol-1-yl]phenyl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | K415-0222 |
| Compound Name: | N-{4-[5-(3,4-dimethoxyphenyl)-1H-1,2,3-triazol-1-yl]phenyl}thiophene-2-carboxamide |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C21 H18 N4 O3 S |
| Smiles: | COc1ccc(cc1OC)c1cnnn1c1ccc(cc1)NC(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8028 |
| logD: | 3.8028 |
| logSw: | -4.0456 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.593 |
| InChI Key: | SPLPLRQZJYEXEE-UHFFFAOYSA-N |