3-[4-(4-chlorophenyl)piperazin-1-yl]-3,4-dihydro-2H-1,5,3lambda~5~-benzodioxaphosphepin-3-one
Chemical Structure Depiction of
3-[4-(4-chlorophenyl)piperazin-1-yl]-3,4-dihydro-2H-1,5,3lambda~5~-benzodioxaphosphepin-3-one
3-[4-(4-chlorophenyl)piperazin-1-yl]-3,4-dihydro-2H-1,5,3lambda~5~-benzodioxaphosphepin-3-one
Compound characteristics
| Compound ID: | 7747-0539 |
| Compound Name: | 3-[4-(4-chlorophenyl)piperazin-1-yl]-3,4-dihydro-2H-1,5,3lambda~5~-benzodioxaphosphepin-3-one |
| Molecular Weight: | 378.79 |
| Molecular Formula: | C18 H20 Cl N2 O3 P |
| Smiles: | C1CN(CCN1c1ccc(cc1)[Cl])P1(COc2ccccc2OC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3607 |
| logD: | 3.3607 |
| logSw: | -3.5821 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.402 |
| InChI Key: | OIUQBPVOSQEEGL-UHFFFAOYSA-N |