6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-4-[(4-methylphenyl)methyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-4-[(4-methylphenyl)methyl]-2H-1,4-benzoxazin-3(4H)-one
6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-4-[(4-methylphenyl)methyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F119-0790 |
| Compound Name: | 6-[4-(3-chlorophenyl)piperazine-1-carbonyl]-4-[(4-methylphenyl)methyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 475.97 |
| Molecular Formula: | C27 H26 Cl N3 O3 |
| Smiles: | Cc1ccc(CN2C(COc3ccc(cc23)C(N2CCN(CC2)c2cccc(c2)[Cl])=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.3195 |
| logD: | 4.3195 |
| logSw: | -4.5475 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.977 |
| InChI Key: | AQZGHPSKHHWTFL-UHFFFAOYSA-N |