N-[(oxolan-2-yl)methyl]-1-{4-[(2,4,5-trimethylbenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[(oxolan-2-yl)methyl]-1-{4-[(2,4,5-trimethylbenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
N-[(oxolan-2-yl)methyl]-1-{4-[(2,4,5-trimethylbenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L164-0063 |
| Compound Name: | N-[(oxolan-2-yl)methyl]-1-{4-[(2,4,5-trimethylbenzene-1-sulfonyl)amino]phenyl}cyclopropane-1-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 556.6 |
| Molecular Formula: | C24 H30 N2 O4 S |
| Salt: | CF3COOH |
| Smiles: | Cc1cc(C)c(cc1C)S(Nc1ccc(cc1)C1(CC1)C(NCC1CCCO1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7781 |
| logD: | 3.7198 |
| logSw: | -3.8857 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.207 |
| InChI Key: | RXGRRSYKWSAQSE-OAQYLSRUSA-N |