2-chloro-N-[2-(piperazine-1-sulfonyl)ethyl]-N-propylbenzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2-chloro-N-[2-(piperazine-1-sulfonyl)ethyl]-N-propylbenzamide--trifluoroacetic acid (1/1)
2-chloro-N-[2-(piperazine-1-sulfonyl)ethyl]-N-propylbenzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L126-0618 |
| Compound Name: | 2-chloro-N-[2-(piperazine-1-sulfonyl)ethyl]-N-propylbenzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 487.92 |
| Molecular Formula: | C16 H24 Cl N3 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCCN(CCS(N1CCNCC1)(=O)=O)C(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 0.9569 |
| logD: | 0.6122 |
| logSw: | -2.9265 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.244 |
| InChI Key: | BHSZCGBYJXRRLJ-UHFFFAOYSA-N |