N-(butan-2-yl)-4-(piperazin-1-yl)-3-[(4-propanamidobenzene-1-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
N-(butan-2-yl)-4-(piperazin-1-yl)-3-[(4-propanamidobenzene-1-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
N-(butan-2-yl)-4-(piperazin-1-yl)-3-[(4-propanamidobenzene-1-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | F919-0893 |
| Compound Name: | N-(butan-2-yl)-4-(piperazin-1-yl)-3-[(4-propanamidobenzene-1-sulfonyl)amino]benzamide--trifluoroacetic acid (1/1) |
| Molecular Weight: | 601.64 |
| Molecular Formula: | C24 H33 N5 O4 S |
| Salt: | CF3COOH |
| Smiles: | CCC(C)NC(c1ccc(c(c1)NS(c1ccc(cc1)NC(CC)=O)(=O)=O)N1CCNCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9106 |
| logD: | 1.9106 |
| logSw: | -2.9358 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 102.578 |
| InChI Key: | LPYPBVNLBJBXEB-KRWDZBQOSA-N |