4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-(3,5-dimethylphenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-(3,5-dimethylphenyl)piperazine-1-carboxamide
4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-(3,5-dimethylphenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | F874-0729 |
| Compound Name: | 4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-(3,5-dimethylphenyl)piperazine-1-carboxamide |
| Molecular Weight: | 398.89 |
| Molecular Formula: | C21 H23 Cl N4 O2 |
| Smiles: | Cc1cc(C)cc(c1)NC(N1CCN(CC1)Cc1nc2cc(ccc2o1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.0997 |
| logD: | 4.0903 |
| logSw: | -4.2854 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.995 |
| InChI Key: | IZANGNUWGACQFB-UHFFFAOYSA-N |