4-chloro-N-(3-phenylpropyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-chloro-N-(3-phenylpropyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
4-chloro-N-(3-phenylpropyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L126-0699 |
| Compound Name: | 4-chloro-N-(3-phenylpropyl)-N-[2-(piperazine-1-sulfonyl)ethyl]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 564.02 |
| Molecular Formula: | C22 H28 Cl N3 O3 S |
| Salt: | CF3COOH |
| Smiles: | C(Cc1ccccc1)CN(CCS(N1CCNCC1)(=O)=O)C(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.6464 |
| logD: | 2.3017 |
| logSw: | -3.6322 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.972 |
| InChI Key: | QYNCTDZTNIZJDX-UHFFFAOYSA-N |