{4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl}[rel-(2R,3S)-4-methyl-3-phenylmorpholin-2-yl]methanone
Chemical Structure Depiction of
{4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl}[rel-(2R,3S)-4-methyl-3-phenylmorpholin-2-yl]methanone
{4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl}[rel-(2R,3S)-4-methyl-3-phenylmorpholin-2-yl]methanone
Compound characteristics
| Compound ID: | S682-0549 |
| Compound Name: | {4-[2-(4-chlorophenoxy)ethyl]piperazin-1-yl}[rel-(2R,3S)-4-methyl-3-phenylmorpholin-2-yl]methanone |
| Molecular Weight: | 443.97 |
| Molecular Formula: | C24 H30 Cl N3 O3 |
| Smiles: | CN1CCO[C@@H](C(N2CCN(CC2)CCOc2ccc(cc2)[Cl])=O)[C@@H]1c1ccccc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.8938 |
| logD: | 2.8742 |
| logSw: | -3.3803 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.424 |
| InChI Key: | NECLQQBYQHTSMQ-PKTZIBPZSA-N |