3-(pyrrolidine-1-carbonyl)-N-[(3,4,5-trimethoxyphenyl)methyl]-1,2-benzoxazole-5-sulfonamide
Chemical Structure Depiction of
3-(pyrrolidine-1-carbonyl)-N-[(3,4,5-trimethoxyphenyl)methyl]-1,2-benzoxazole-5-sulfonamide
3-(pyrrolidine-1-carbonyl)-N-[(3,4,5-trimethoxyphenyl)methyl]-1,2-benzoxazole-5-sulfonamide
Compound characteristics
| Compound ID: | L995-0244 |
| Compound Name: | 3-(pyrrolidine-1-carbonyl)-N-[(3,4,5-trimethoxyphenyl)methyl]-1,2-benzoxazole-5-sulfonamide |
| Molecular Weight: | 475.52 |
| Molecular Formula: | C22 H25 N3 O7 S |
| Smiles: | COc1cc(CNS(c2ccc3c(c2)c(C(N2CCCC2)=O)no3)(=O)=O)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.5766 |
| logD: | 2.5764 |
| logSw: | -3.119 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 104.188 |
| InChI Key: | FDIXUXQZKBCYOK-UHFFFAOYSA-N |