N-(3-phenylpropyl)-N-[2-(piperazine-1-sulfonyl)ethyl]-2-(thiophen-2-yl)acetamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-(3-phenylpropyl)-N-[2-(piperazine-1-sulfonyl)ethyl]-2-(thiophen-2-yl)acetamide--trifluoroacetic acid (1/1)
N-(3-phenylpropyl)-N-[2-(piperazine-1-sulfonyl)ethyl]-2-(thiophen-2-yl)acetamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L126-0692 |
| Compound Name: | N-(3-phenylpropyl)-N-[2-(piperazine-1-sulfonyl)ethyl]-2-(thiophen-2-yl)acetamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 549.63 |
| Molecular Formula: | C21 H29 N3 O3 S2 |
| Salt: | CF3COOH |
| Smiles: | C(Cc1ccccc1)CN(CCS(N1CCNCC1)(=O)=O)C(Cc1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8822 |
| logD: | 1.5376 |
| logSw: | -2.4926 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.463 |
| InChI Key: | KYQGDZPSRCANPK-UHFFFAOYSA-N |