4-benzyl-6-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-2H-1,4-benzoxazin-3(4H)-one
Chemical Structure Depiction of
4-benzyl-6-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-2H-1,4-benzoxazin-3(4H)-one
4-benzyl-6-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-2H-1,4-benzoxazin-3(4H)-one
Compound characteristics
| Compound ID: | F119-0046 |
| Compound Name: | 4-benzyl-6-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-2H-1,4-benzoxazin-3(4H)-one |
| Molecular Weight: | 457.53 |
| Molecular Formula: | C27 H27 N3 O4 |
| Smiles: | COc1cccc(c1)N1CCN(CC1)C(c1ccc2c(c1)N(Cc1ccccc1)C(CO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4205 |
| logD: | 3.4205 |
| logSw: | -3.7896 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.521 |
| InChI Key: | SDJCMCLUCBMNAP-UHFFFAOYSA-N |