N-(2-ethyl-6-methylphenyl)-3-(pyrrolidine-1-carbonyl)-1,2-benzoxazole-5-sulfonamide
Chemical Structure Depiction of
N-(2-ethyl-6-methylphenyl)-3-(pyrrolidine-1-carbonyl)-1,2-benzoxazole-5-sulfonamide
N-(2-ethyl-6-methylphenyl)-3-(pyrrolidine-1-carbonyl)-1,2-benzoxazole-5-sulfonamide
Compound characteristics
| Compound ID: | L995-0132 |
| Compound Name: | N-(2-ethyl-6-methylphenyl)-3-(pyrrolidine-1-carbonyl)-1,2-benzoxazole-5-sulfonamide |
| Molecular Weight: | 413.49 |
| Molecular Formula: | C21 H23 N3 O4 S |
| Smiles: | CCc1cccc(C)c1NS(c1ccc2c(c1)c(C(N1CCCC1)=O)no2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5332 |
| logD: | 3.517 |
| logSw: | -3.7162 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.706 |
| InChI Key: | WHCGVUWVNVDTJD-UHFFFAOYSA-N |