3-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one
3-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | C082-0682 |
| Compound Name: | 3-{2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-oxoethyl}-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 385.85 |
| Molecular Formula: | C20 H20 Cl N3 O3 |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)C(CN1C(=O)Oc2ccccc12)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.4507 |
| logD: | 3.4507 |
| logSw: | -3.9021 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.419 |
| InChI Key: | TWBSSGIQTHFAOU-UHFFFAOYSA-N |