3-[(2,5-dimethylbenzene-1-sulfonyl)amino]-N-methyl-N-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-[(2,5-dimethylbenzene-1-sulfonyl)amino]-N-methyl-N-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
3-[(2,5-dimethylbenzene-1-sulfonyl)amino]-N-methyl-N-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0230 |
| Compound Name: | 3-[(2,5-dimethylbenzene-1-sulfonyl)amino]-N-methyl-N-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 627.68 |
| Molecular Formula: | C26 H35 N5 O4 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(C)c(c1)S(Nc1cc(ccc1N1CCNCC1)C(N(C)CC(N1CCCC1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9604 |
| logD: | 1.9604 |
| logSw: | -2.8668 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.211 |
| InChI Key: | ASFNCWYKFHNBMY-UHFFFAOYSA-N |