4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-(3-methylphenyl)piperazine-1-carboxamide
Chemical Structure Depiction of
4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-(3-methylphenyl)piperazine-1-carboxamide
4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-(3-methylphenyl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | F874-0751 |
| Compound Name: | 4-[(5-chloro-1,3-benzoxazol-2-yl)methyl]-N-(3-methylphenyl)piperazine-1-carboxamide |
| Molecular Weight: | 384.86 |
| Molecular Formula: | C20 H21 Cl N4 O2 |
| Smiles: | Cc1cccc(c1)NC(N1CCN(CC1)Cc1nc2cc(ccc2o1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7666 |
| logD: | 3.7573 |
| logSw: | -4.0122 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.995 |
| InChI Key: | ZSOQLGFTNJLOER-UHFFFAOYSA-N |