5-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-3-[(4-methylphenyl)methyl]-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
5-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-3-[(4-methylphenyl)methyl]-1,3-benzoxazol-2(3H)-one
5-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-3-[(4-methylphenyl)methyl]-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | F601-0792 |
| Compound Name: | 5-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]-3-[(4-methylphenyl)methyl]-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 455.56 |
| Molecular Formula: | C28 H29 N3 O3 |
| Smiles: | Cc1ccc(CN2C(=O)Oc3ccc(cc23)C(N2CCN(CC2)c2cc(C)ccc2C)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.3388 |
| logD: | 5.3388 |
| logSw: | -5.2861 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 42.675 |
| InChI Key: | TVUZNNKCXJWQDE-UHFFFAOYSA-N |