N-{4-[5-(3,4-dimethoxyphenyl)-1H-1,2,3-triazol-1-yl]phenyl}-4-(pyrrolidine-1-sulfonyl)benzamide
Chemical Structure Depiction of
N-{4-[5-(3,4-dimethoxyphenyl)-1H-1,2,3-triazol-1-yl]phenyl}-4-(pyrrolidine-1-sulfonyl)benzamide
N-{4-[5-(3,4-dimethoxyphenyl)-1H-1,2,3-triazol-1-yl]phenyl}-4-(pyrrolidine-1-sulfonyl)benzamide
Compound characteristics
| Compound ID: | K415-0217 |
| Compound Name: | N-{4-[5-(3,4-dimethoxyphenyl)-1H-1,2,3-triazol-1-yl]phenyl}-4-(pyrrolidine-1-sulfonyl)benzamide |
| Molecular Weight: | 533.61 |
| Molecular Formula: | C27 H27 N5 O5 S |
| Smiles: | COc1ccc(cc1OC)c1cnnn1c1ccc(cc1)NC(c1ccc(cc1)S(N1CCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.657 |
| logD: | 3.6567 |
| logSw: | -3.8525 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.652 |
| InChI Key: | PIQBAVUCIQTDNE-UHFFFAOYSA-N |