3-[(2,5-dimethylbenzene-1-sulfonyl)amino]-N,N-dimethyl-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-[(2,5-dimethylbenzene-1-sulfonyl)amino]-N,N-dimethyl-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
3-[(2,5-dimethylbenzene-1-sulfonyl)amino]-N,N-dimethyl-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0219 |
| Compound Name: | 3-[(2,5-dimethylbenzene-1-sulfonyl)amino]-N,N-dimethyl-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 530.57 |
| Molecular Formula: | C21 H28 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(C)c(c1)S(Nc1cc(ccc1N1CCNCC1)C(N(C)C)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7031 |
| logD: | 1.7031 |
| logSw: | -2.661 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.303 |
| InChI Key: | ROOIATCOJJEUSL-UHFFFAOYSA-N |