N-butyl-5-[(4-tert-butylbenzene-1-sulfonyl)amino]-N-methyl-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-butyl-5-[(4-tert-butylbenzene-1-sulfonyl)amino]-N-methyl-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
N-butyl-5-[(4-tert-butylbenzene-1-sulfonyl)amino]-N-methyl-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | L268-0650 |
| Compound Name: | N-butyl-5-[(4-tert-butylbenzene-1-sulfonyl)amino]-N-methyl-2-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 600.7 |
| Molecular Formula: | C26 H38 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCCCN(C)C(c1cc(ccc1N1CCNCC1)NS(c1ccc(cc1)C(C)(C)C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5252 |
| logD: | 3.0497 |
| logSw: | -4.1107 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.401 |
| InChI Key: | JLLRXEZXTDUKHR-UHFFFAOYSA-N |