N-cycloheptyl-N-[2-(piperazine-1-sulfonyl)ethyl]thiophene-2-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-cycloheptyl-N-[2-(piperazine-1-sulfonyl)ethyl]thiophene-2-carboxamide--trifluoroacetic acid (1/1)
N-cycloheptyl-N-[2-(piperazine-1-sulfonyl)ethyl]thiophene-2-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L126-0090 |
| Compound Name: | N-cycloheptyl-N-[2-(piperazine-1-sulfonyl)ethyl]thiophene-2-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 513.6 |
| Molecular Formula: | C18 H29 N3 O3 S2 |
| Salt: | CF3COOH |
| Smiles: | C1CCCC(CC1)N(CCS(N1CCNCC1)(=O)=O)C(c1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2816 |
| logD: | 1.9369 |
| logSw: | -2.6469 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.588 |
| InChI Key: | OJMJUGHJZRJFDI-UHFFFAOYSA-N |