methyl 3-({4-[(6-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)benzoate
Chemical Structure Depiction of
methyl 3-({4-[(6-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)benzoate
methyl 3-({4-[(6-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | F874-0690 |
| Compound Name: | methyl 3-({4-[(6-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)benzoate |
| Molecular Weight: | 408.46 |
| Molecular Formula: | C22 H24 N4 O4 |
| Smiles: | Cc1ccc2c(c1)oc(CN1CCN(CC1)C(Nc1cccc(c1)C(=O)OC)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 3.5304 |
| logD: | 3.521 |
| logSw: | -3.568 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.169 |
| InChI Key: | HGKSCBIRCNXSNE-UHFFFAOYSA-N |