4-(piperazin-1-yl)-N-[(pyridin-3-yl)methyl]-3-[(thiophene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
4-(piperazin-1-yl)-N-[(pyridin-3-yl)methyl]-3-[(thiophene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
4-(piperazin-1-yl)-N-[(pyridin-3-yl)methyl]-3-[(thiophene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0802 |
| Compound Name: | 4-(piperazin-1-yl)-N-[(pyridin-3-yl)methyl]-3-[(thiophene-2-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 571.6 |
| Molecular Formula: | C21 H23 N5 O3 S2 |
| Salt: | CF3COOH |
| Smiles: | C1CN(CCN1)c1ccc(cc1NS(c1cccs1)(=O)=O)C(NCc1cccnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.457 |
| logD: | 1.457 |
| logSw: | -2.0631 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.252 |
| InChI Key: | UATJCBCPAGPOTN-UHFFFAOYSA-N |