2-(4-{2-(4-chlorophenyl)-2-[(3-methoxyphenyl)methoxy]ethyl}piperazine-1-sulfonyl)benzonitrile
Chemical Structure Depiction of
2-(4-{2-(4-chlorophenyl)-2-[(3-methoxyphenyl)methoxy]ethyl}piperazine-1-sulfonyl)benzonitrile
2-(4-{2-(4-chlorophenyl)-2-[(3-methoxyphenyl)methoxy]ethyl}piperazine-1-sulfonyl)benzonitrile
Compound characteristics
| Compound ID: | V006-0657 |
| Compound Name: | 2-(4-{2-(4-chlorophenyl)-2-[(3-methoxyphenyl)methoxy]ethyl}piperazine-1-sulfonyl)benzonitrile |
| Molecular Weight: | 526.05 |
| Molecular Formula: | C27 H28 Cl N3 O4 S |
| Salt: | not_available |
| Smiles: | COc1cccc(COC(CN2CCN(CC2)S(c2ccccc2C#N)(=O)=O)c2ccc(cc2)[Cl])c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.486 |
| logD: | 4.4848 |
| logSw: | -4.7846 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.97 |
| InChI Key: | UVDDDJWEEXBZKU-SANMLTNESA-N |