N-(3-chloro-2-methylphenyl)-4-{[5-(piperidine-1-carbonyl)-1,3-benzoxazol-2-yl]methyl}piperazine-1-carboxamide
Chemical Structure Depiction of
N-(3-chloro-2-methylphenyl)-4-{[5-(piperidine-1-carbonyl)-1,3-benzoxazol-2-yl]methyl}piperazine-1-carboxamide
N-(3-chloro-2-methylphenyl)-4-{[5-(piperidine-1-carbonyl)-1,3-benzoxazol-2-yl]methyl}piperazine-1-carboxamide
Compound characteristics
| Compound ID: | L407-0094 |
| Compound Name: | N-(3-chloro-2-methylphenyl)-4-{[5-(piperidine-1-carbonyl)-1,3-benzoxazol-2-yl]methyl}piperazine-1-carboxamide |
| Molecular Weight: | 496.01 |
| Molecular Formula: | C26 H30 Cl N5 O3 |
| Smiles: | Cc1c(cccc1[Cl])NC(N1CCN(CC1)Cc1nc2cc(ccc2o1)C(N1CCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8982 |
| logD: | 3.8888 |
| logSw: | -4.1909 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.946 |
| InChI Key: | ZJYDOVYWMCBDPG-UHFFFAOYSA-N |