3-[(4-fluorobenzene-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-[(4-fluorobenzene-1-sulfonyl)amino]-N-methyl-N-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
3-[(4-fluorobenzene-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: | F919-0028 |
| Compound Name: | 3-[(4-fluorobenzene-1-sulfonyl)amino]-N-methyl-N-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 617.62 |
| Molecular Formula: | C24 H30 F N5 O4 S |
| Salt: | CF3COOH |
| Smiles: | CN(CC(N1CCCC1)=O)C(c1ccc(c(c1)NS(c1ccc(cc1)F)(=O)=O)N1CCNCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2237 |
| logD: | 1.2237 |
| logSw: | -2.6167 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.211 |
| InChI Key: | LNQHKBTWJNMZJK-UHFFFAOYSA-N |