N-ethyl-4-(piperazin-1-yl)-3-[(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-ethyl-4-(piperazin-1-yl)-3-[(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
N-ethyl-4-(piperazin-1-yl)-3-[(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0992 |
| Compound Name: | N-ethyl-4-(piperazin-1-yl)-3-[(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 556.6 |
| Molecular Formula: | C23 H30 N4 O3 S |
| Salt: | CF3COOH |
| Smiles: | CCNC(c1ccc(c(c1)NS(c1ccc2CCCCc2c1)(=O)=O)N1CCNCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.806 |
| logD: | 2.806 |
| logSw: | -3.6108 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.534 |
| InChI Key: | ZMMUCCHKWZHGRS-UHFFFAOYSA-N |