ethyl 4-({4-[(6-chloro-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)benzoate
Chemical Structure Depiction of
ethyl 4-({4-[(6-chloro-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)benzoate
ethyl 4-({4-[(6-chloro-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | F874-0552 |
| Compound Name: | ethyl 4-({4-[(6-chloro-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)benzoate |
| Molecular Weight: | 442.9 |
| Molecular Formula: | C22 H23 Cl N4 O4 |
| Smiles: | CCOC(c1ccc(cc1)NC(N1CCN(CC1)Cc1nc2ccc(cc2o1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.173 |
| logD: | 4.1636 |
| logSw: | -4.3362 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.749 |
| InChI Key: | KGYXCYJOFNQKLM-UHFFFAOYSA-N |