7-[4-(tert-butoxycarbonyl)piperazin-1-yl]-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Chemical Structure Depiction of
7-[4-(tert-butoxycarbonyl)piperazin-1-yl]-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
7-[4-(tert-butoxycarbonyl)piperazin-1-yl]-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
Compound characteristics
| Compound ID: | D715-2343 |
| Compound Name: | 7-[4-(tert-butoxycarbonyl)piperazin-1-yl]-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid |
| Molecular Weight: | 419.45 |
| Molecular Formula: | C21 H26 F N3 O5 |
| Smiles: | CCN1C=C(C(O)=O)C(c2cc(c(cc12)N1CCN(CC1)C(=O)OC(C)(C)C)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0484 |
| logD: | -0.1378 |
| logSw: | -2.2298 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.008 |
| InChI Key: | UCJKZMMQWNRWCL-UHFFFAOYSA-N |