N'-tert-butyl-N-methyl-N-{[3-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}urea
Chemical Structure Depiction of
N'-tert-butyl-N-methyl-N-{[3-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}urea
N'-tert-butyl-N-methyl-N-{[3-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}urea
Compound characteristics
| Compound ID: | V029-7120 |
| Compound Name: | N'-tert-butyl-N-methyl-N-{[3-(4-methylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}urea |
| Molecular Weight: | 303.4 |
| Molecular Formula: | C17 H25 N3 O2 |
| Smiles: | Cc1ccc(cc1)C1CC(CN(C)C(NC(C)(C)C)=O)ON=1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4621 |
| logD: | 3.462 |
| logSw: | -3.4699 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.463 |
| InChI Key: | CZARGBLJLGAULB-CQSZACIVSA-N |