N-methyl-3-[(4-methylbenzene-1-sulfonyl)amino]-N-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-methyl-3-[(4-methylbenzene-1-sulfonyl)amino]-N-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
N-methyl-3-[(4-methylbenzene-1-sulfonyl)amino]-N-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0206 |
| Compound Name: | N-methyl-3-[(4-methylbenzene-1-sulfonyl)amino]-N-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 613.66 |
| Molecular Formula: | C25 H33 N5 O4 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(cc1)S(Nc1cc(ccc1N1CCNCC1)C(N(C)CC(N1CCCC1)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6181 |
| logD: | 1.6181 |
| logSw: | -2.7897 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 88.211 |
| InChI Key: | QTCFMJIHCISWDB-UHFFFAOYSA-N |