5-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-[(4-methylphenyl)methyl]-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
5-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-[(4-methylphenyl)methyl]-1,3-benzoxazol-2(3H)-one
5-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-[(4-methylphenyl)methyl]-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | F601-0790 |
| Compound Name: | 5-[4-(3-chlorophenyl)piperazine-1-carbonyl]-3-[(4-methylphenyl)methyl]-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 461.95 |
| Molecular Formula: | C26 H24 Cl N3 O3 |
| Smiles: | Cc1ccc(CN2C(=O)Oc3ccc(cc23)C(N2CCN(CC2)c2cccc(c2)[Cl])=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7645 |
| logD: | 4.7645 |
| logSw: | -4.9351 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.976 |
| InChI Key: | ZPACFOZVNUOWIY-UHFFFAOYSA-N |