3-chloro-4-methoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(pyrrolidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-chloro-4-methoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(pyrrolidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
3-chloro-4-methoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(pyrrolidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F482-1156 |
| Compound Name: | 3-chloro-4-methoxy-N-[3-oxo-3-(piperazin-1-yl)propyl]-N-[3-(pyrrolidin-1-yl)propyl]benzene-1-sulfonamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 587.06 |
| Molecular Formula: | C21 H33 Cl N4 O4 S |
| Salt: | CF3COOH |
| Smiles: | COc1ccc(cc1[Cl])S(N(CCCN1CCCC1)CCC(N1CCNCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9211 |
| logD: | -1.265 |
| logSw: | -2.8815 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.631 |
| InChI Key: | XRNIGAZAXFAXTK-UHFFFAOYSA-N |