N-(3-chloro-2-methylphenyl)-4-[(5-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carboxamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-4-[(5-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carboxamide
N-(3-chloro-2-methylphenyl)-4-[(5-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | F874-0846 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-4-[(5-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carboxamide |
| Molecular Weight: | 398.89 |
| Molecular Formula: | C21 H23 Cl N4 O2 |
| Smiles: | Cc1ccc2c(c1)nc(CN1CCN(CC1)C(Nc1cccc(c1C)[Cl])=O)o2 |
| Stereo: | ACHIRAL |
| logP: | 4.3901 |
| logD: | 4.3807 |
| logSw: | -4.3764 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.298 |
| InChI Key: | JIBIJIRPTQQSJQ-UHFFFAOYSA-N |