N-{[3-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N'-tert-butyl-N-[(4-fluorophenyl)methyl]urea
Chemical Structure Depiction of
N-{[3-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N'-tert-butyl-N-[(4-fluorophenyl)methyl]urea
N-{[3-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N'-tert-butyl-N-[(4-fluorophenyl)methyl]urea
Compound characteristics
| Compound ID: | V029-0023 |
| Compound Name: | N-{[3-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N'-tert-butyl-N-[(4-fluorophenyl)methyl]urea |
| Molecular Weight: | 427.47 |
| Molecular Formula: | C23 H26 F N3 O4 |
| Salt: | not_available |
| Smiles: | CC(C)(C)NC(N(CC1CC(c2ccc3c(c2)OCO3)=NO1)Cc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.461 |
| logD: | 4.461 |
| logSw: | -4.3405 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.368 |
| InChI Key: | VGUTWBYTRPAVKR-GOSISDBHSA-N |