N-(3-methoxypropyl)-2-(piperazin-1-yl)-5-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}pyridine-3-carboxamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-(3-methoxypropyl)-2-(piperazin-1-yl)-5-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}pyridine-3-carboxamide--trifluoroacetic acid (1/1)
N-(3-methoxypropyl)-2-(piperazin-1-yl)-5-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}pyridine-3-carboxamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L346-0399 |
| Compound Name: | N-(3-methoxypropyl)-2-(piperazin-1-yl)-5-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}pyridine-3-carboxamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 589.63 |
| Molecular Formula: | C23 H33 N5 O4 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)c1ccc(cc1)S(Nc1cc(C(NCCCOC)=O)c(nc1)N1CCNCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9314 |
| logD: | 1.4533 |
| logSw: | -3.4515 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 98.24 |
| InChI Key: | MQVZXCXYJPWDOS-UHFFFAOYSA-N |