propyl [6-(4-cyclohexylpiperazine-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]acetate--hydrogen chloride (1/1)
Chemical Structure Depiction of
propyl [6-(4-cyclohexylpiperazine-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]acetate--hydrogen chloride (1/1)
propyl [6-(4-cyclohexylpiperazine-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]acetate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | F064-1255 |
| Compound Name: | propyl [6-(4-cyclohexylpiperazine-1-sulfonyl)-2-oxo-1,3-benzoxazol-3(2H)-yl]acetate--hydrogen chloride (1/1) |
| Molecular Weight: | 502.03 |
| Molecular Formula: | C22 H31 N3 O6 S |
| Salt: | HCl |
| Smiles: | CCCOC(CN1C(=O)Oc2cc(ccc12)S(N1CCN(CC1)C1CCCCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9985 |
| logD: | 2.9192 |
| logSw: | -3.436 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 78.596 |
| InChI Key: | JEYAPFHOVVNZBG-UHFFFAOYSA-N |