5-chloro-2-methoxy-N-[(oxolan-2-yl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-chloro-2-methoxy-N-[(oxolan-2-yl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
5-chloro-2-methoxy-N-[(oxolan-2-yl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-0520 |
| Compound Name: | 5-chloro-2-methoxy-N-[(oxolan-2-yl)methyl]-N-[3-oxo-3-(piperazin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 559.99 |
| Molecular Formula: | C19 H28 Cl N3 O5 S |
| Salt: | CF3COOH |
| Smiles: | COc1ccc(cc1S(N(CCC(N1CCNCC1)=O)CC1CCCO1)(=O)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.4698 |
| logD: | -0.3582 |
| logSw: | -2.7612 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.959 |
| InChI Key: | SAWXIIOEXFXVFY-MRXNPFEDSA-N |