N-(2-{4-[(1,3-benzoxazol-2-yl)methyl]piperazine-1-sulfonyl}-4-methylphenyl)acetamide
Chemical Structure Depiction of
N-(2-{4-[(1,3-benzoxazol-2-yl)methyl]piperazine-1-sulfonyl}-4-methylphenyl)acetamide
N-(2-{4-[(1,3-benzoxazol-2-yl)methyl]piperazine-1-sulfonyl}-4-methylphenyl)acetamide
Compound characteristics
| Compound ID: | F874-0070 |
| Compound Name: | N-(2-{4-[(1,3-benzoxazol-2-yl)methyl]piperazine-1-sulfonyl}-4-methylphenyl)acetamide |
| Molecular Weight: | 428.51 |
| Molecular Formula: | C21 H24 N4 O4 S |
| Smiles: | [H]c1ccc2c(c1)nc(CN1CCN(CC1)S(c1cc(C)ccc1NC(C)=O)(=O)=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 2.1061 |
| logD: | 2.1058 |
| logSw: | -2.9235 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.801 |
| InChI Key: | VAKOQEROLMKMNV-UHFFFAOYSA-N |