{5-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-1,2-benzoxazol-3-yl}(pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
{5-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-1,2-benzoxazol-3-yl}(pyrrolidin-1-yl)methanone
{5-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-1,2-benzoxazol-3-yl}(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | L995-0083 |
| Compound Name: | {5-[4-(2,5-dimethylphenyl)piperazine-1-sulfonyl]-1,2-benzoxazol-3-yl}(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 468.57 |
| Molecular Formula: | C24 H28 N4 O4 S |
| Smiles: | Cc1ccc(C)c(c1)N1CCN(CC1)S(c1ccc2c(c1)c(C(N1CCCC1)=O)no2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1637 |
| logD: | 4.1637 |
| logSw: | -4.2261 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.122 |
| InChI Key: | UYHIOEZSNOLJDJ-UHFFFAOYSA-N |