2-(piperazin-1-yl)-5-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}-N,N-dipropylpyridine-3-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
2-(piperazin-1-yl)-5-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}-N,N-dipropylpyridine-3-carboxamide--trifluoroacetic acid (1/1)
2-(piperazin-1-yl)-5-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}-N,N-dipropylpyridine-3-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L346-0402 |
| Compound Name: | 2-(piperazin-1-yl)-5-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}-N,N-dipropylpyridine-3-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 601.69 |
| Molecular Formula: | C25 H37 N5 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCCN(CCC)C(c1cc(cnc1N1CCNCC1)NS(c1ccc(cc1)C(C)C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2765 |
| logD: | 2.7985 |
| logSw: | -3.9843 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.811 |
| InChI Key: | SQSQSGMWCBARNC-UHFFFAOYSA-N |