N'-tert-butyl-N-{[3-(3,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-[(4-fluorophenyl)methyl]urea
Chemical Structure Depiction of
N'-tert-butyl-N-{[3-(3,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-[(4-fluorophenyl)methyl]urea
N'-tert-butyl-N-{[3-(3,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-[(4-fluorophenyl)methyl]urea
Compound characteristics
| Compound ID: | V013-4607 |
| Compound Name: | N'-tert-butyl-N-{[3-(3,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-[(4-fluorophenyl)methyl]urea |
| Molecular Weight: | 443.52 |
| Molecular Formula: | C24 H30 F N3 O4 |
| Smiles: | CC(C)(C)NC(N(CC1CC(c2ccc(c(c2)OC)OC)=NO1)Cc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1628 |
| logD: | 4.1628 |
| logSw: | -4.3048 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.513 |
| InChI Key: | KGCMJKLADFSHTP-LJQANCHMSA-N |