N-[(3-methoxyphenyl)methyl]-3,4-dimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[(3-methoxyphenyl)methyl]-3,4-dimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
N-[(3-methoxyphenyl)methyl]-3,4-dimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-0663 |
| Compound Name: | N-[(3-methoxyphenyl)methyl]-3,4-dimethyl-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 559.6 |
| Molecular Formula: | C23 H31 N3 O4 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(cc1C)S(N(CCC(N1CCNCC1)=O)Cc1cccc(c1)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.697 |
| logD: | 1.8691 |
| logSw: | -3.1073 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.218 |
| InChI Key: | UFVQTWAJHLCHNK-UHFFFAOYSA-N |