N-benzyl-N-ethyl-5-[(4-methylbenzene-1-sulfonyl)amino]-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-benzyl-N-ethyl-5-[(4-methylbenzene-1-sulfonyl)amino]-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
N-benzyl-N-ethyl-5-[(4-methylbenzene-1-sulfonyl)amino]-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L268-0219 |
| Compound Name: | N-benzyl-N-ethyl-5-[(4-methylbenzene-1-sulfonyl)amino]-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 606.66 |
| Molecular Formula: | C27 H32 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCN(Cc1ccccc1)C(c1cc(ccc1N1CCNCC1)NS(c1ccc(C)cc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.947 |
| logD: | 2.4714 |
| logSw: | -3.8618 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.936 |
| InChI Key: | LMVVOZZESSQHOH-UHFFFAOYSA-N |