methyl 4-chloro-2-({4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)benzoate
Chemical Structure Depiction of
methyl 4-chloro-2-({4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)benzoate
methyl 4-chloro-2-({4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)benzoate
Compound characteristics
| Compound ID: | G373-3526 |
| Compound Name: | methyl 4-chloro-2-({4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]piperazine-1-carbonyl}amino)benzoate |
| Molecular Weight: | 463.32 |
| Molecular Formula: | C21 H20 Cl2 N4 O4 |
| Smiles: | COC(c1ccc(cc1NC(N1CCN(CC1)Cc1nc2cc(ccc2o1)[Cl])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.0221 |
| logD: | 3.954 |
| logSw: | -4.4509 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.471 |
| InChI Key: | PSLHAWFUBAANFC-UHFFFAOYSA-N |