3-[(4-acetamidobenzene-1-sulfonyl)amino]-N-butyl-N-ethyl-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
3-[(4-acetamidobenzene-1-sulfonyl)amino]-N-butyl-N-ethyl-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
3-[(4-acetamidobenzene-1-sulfonyl)amino]-N-butyl-N-ethyl-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0100 |
| Compound Name: | 3-[(4-acetamidobenzene-1-sulfonyl)amino]-N-butyl-N-ethyl-4-(piperazin-1-yl)benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 615.67 |
| Molecular Formula: | C25 H35 N5 O4 S |
| Salt: | CF3COOH |
| Smiles: | CCCCN(CC)C(c1ccc(c(c1)NS(c1ccc(cc1)NC(C)=O)(=O)=O)N1CCNCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3929 |
| logD: | 2.3929 |
| logSw: | -3.0958 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 94.75 |
| InChI Key: | WREKQSBXVRILSJ-UHFFFAOYSA-N |