{4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl}(4,5,6,7-tetrahydro-1,2-benzoxazol-3-yl)methanone
Chemical Structure Depiction of
{4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl}(4,5,6,7-tetrahydro-1,2-benzoxazol-3-yl)methanone
{4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl}(4,5,6,7-tetrahydro-1,2-benzoxazol-3-yl)methanone
Compound characteristics
| Compound ID: | Y502-8823 |
| Compound Name: | {4-[(2,4-dichlorophenyl)methyl]piperazin-1-yl}(4,5,6,7-tetrahydro-1,2-benzoxazol-3-yl)methanone |
| Molecular Weight: | 394.3 |
| Molecular Formula: | C19 H21 Cl2 N3 O2 |
| Smiles: | C1CCc2c(C1)c(C(N1CCN(CC1)Cc1ccc(cc1[Cl])[Cl])=O)no2 |
| Stereo: | ACHIRAL |
| logP: | 3.6908 |
| logD: | 3.6895 |
| logSw: | -3.917 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.827 |
| InChI Key: | DTONOCDMMAUBLP-UHFFFAOYSA-N |