N,N-dimethyl-4-(piperazin-1-yl)-3-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N,N-dimethyl-4-(piperazin-1-yl)-3-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}benzamide--trifluoroacetic acid (1/1)
N,N-dimethyl-4-(piperazin-1-yl)-3-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0360 |
| Compound Name: | N,N-dimethyl-4-(piperazin-1-yl)-3-{[4-(propan-2-yl)benzene-1-sulfonyl]amino}benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 544.59 |
| Molecular Formula: | C22 H30 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | CC(C)c1ccc(cc1)S(Nc1cc(ccc1N1CCNCC1)C(N(C)C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2756 |
| logD: | 2.2756 |
| logSw: | -3.1152 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.303 |
| InChI Key: | KDCWSBCEGSAKDL-UHFFFAOYSA-N |