N-[(oxolan-2-yl)methyl]-2-(piperazin-1-yl)-5-[(4-propylbenzene-1-sulfonyl)amino]pyridine-3-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-[(oxolan-2-yl)methyl]-2-(piperazin-1-yl)-5-[(4-propylbenzene-1-sulfonyl)amino]pyridine-3-carboxamide--trifluoroacetic acid (1/1)
N-[(oxolan-2-yl)methyl]-2-(piperazin-1-yl)-5-[(4-propylbenzene-1-sulfonyl)amino]pyridine-3-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L346-0529 |
| Compound Name: | N-[(oxolan-2-yl)methyl]-2-(piperazin-1-yl)-5-[(4-propylbenzene-1-sulfonyl)amino]pyridine-3-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 601.64 |
| Molecular Formula: | C24 H33 N5 O4 S |
| Salt: | CF3COOH |
| Smiles: | CCCc1ccc(cc1)S(Nc1cc(C(NCC2CCCO2)=O)c(nc1)N1CCNCC1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8568 |
| logD: | 1.3787 |
| logSw: | -3.4605 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 98.439 |
| InChI Key: | BQEDPPWFCXWAQE-HXUWFJFHSA-N |