ethyl N-methyl-N-[4-(piperazin-1-yl)-3-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}benzoyl]glycinate--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
ethyl N-methyl-N-[4-(piperazin-1-yl)-3-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}benzoyl]glycinate--trifluoroacetic acid (1/1)
ethyl N-methyl-N-[4-(piperazin-1-yl)-3-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}benzoyl]glycinate--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0370 |
| Compound Name: | ethyl N-methyl-N-[4-(piperazin-1-yl)-3-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}benzoyl]glycinate--trifluoroacetic acid (1/1) |
| Molecular Weight: | 616.66 |
| Molecular Formula: | C25 H34 N4 O5 S |
| Salt: | CF3COOH |
| Smiles: | CCOC(CN(C)C(c1ccc(c(c1)NS(c1ccc(cc1)C(C)C)(=O)=O)N1CCNCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8843 |
| logD: | 2.8843 |
| logSw: | -3.6427 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.883 |
| InChI Key: | APMKWYIKHSWOAZ-UHFFFAOYSA-N |