2-{[4-(3-tert-butoxy-2-hydroxypropyl)piperazin-1-yl]methyl}-N-(3-chloro-4-fluorophenyl)-1,3-oxazole-4-carboxamide
Chemical Structure Depiction of
2-{[4-(3-tert-butoxy-2-hydroxypropyl)piperazin-1-yl]methyl}-N-(3-chloro-4-fluorophenyl)-1,3-oxazole-4-carboxamide
2-{[4-(3-tert-butoxy-2-hydroxypropyl)piperazin-1-yl]methyl}-N-(3-chloro-4-fluorophenyl)-1,3-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | V014-0205 |
| Compound Name: | 2-{[4-(3-tert-butoxy-2-hydroxypropyl)piperazin-1-yl]methyl}-N-(3-chloro-4-fluorophenyl)-1,3-oxazole-4-carboxamide |
| Molecular Weight: | 468.96 |
| Molecular Formula: | C22 H30 Cl F N4 O4 |
| Salt: | not_available |
| Smiles: | CC(C)(C)OCC(CN1CCN(CC1)Cc1nc(co1)C(Nc1ccc(c(c1)[Cl])F)=O)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8285 |
| logD: | 2.576 |
| logSw: | -3.2397 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.613 |
| InChI Key: | DDTSXHAYTJVLNB-INIZCTEOSA-N |