3-methyl-N-(4-{4-[(5-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-sulfonyl}phenyl)butanamide
Chemical Structure Depiction of
3-methyl-N-(4-{4-[(5-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-sulfonyl}phenyl)butanamide
3-methyl-N-(4-{4-[(5-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-sulfonyl}phenyl)butanamide
Compound characteristics
| Compound ID: | F874-0226 |
| Compound Name: | 3-methyl-N-(4-{4-[(5-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-sulfonyl}phenyl)butanamide |
| Molecular Weight: | 470.59 |
| Molecular Formula: | C24 H30 N4 O4 S |
| Smiles: | CC(C)CC(Nc1ccc(cc1)S(N1CCN(CC1)Cc1nc2cc(C)ccc2o1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.727 |
| logD: | 3.7255 |
| logSw: | -3.9445 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.387 |
| InChI Key: | YVHDHKIBHYOQCE-UHFFFAOYSA-N |