3-[(3-chloro-4-methylbenzene-1-sulfonyl)amino]-N-(2-methoxyethyl)-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-[(3-chloro-4-methylbenzene-1-sulfonyl)amino]-N-(2-methoxyethyl)-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
3-[(3-chloro-4-methylbenzene-1-sulfonyl)amino]-N-(2-methoxyethyl)-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0976 |
| Compound Name: | 3-[(3-chloro-4-methylbenzene-1-sulfonyl)amino]-N-(2-methoxyethyl)-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 581.01 |
| Molecular Formula: | C21 H27 Cl N4 O4 S |
| Salt: | CF3COOH |
| Smiles: | Cc1ccc(cc1[Cl])S(Nc1cc(ccc1N1CCNCC1)C(NCCOC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4744 |
| logD: | 2.4744 |
| logSw: | -3.4685 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.171 |
| InChI Key: | CRBSWCASQHRUEE-UHFFFAOYSA-N |