N'-tert-butyl-N-[(3-chlorophenyl)methyl]-N-{[3-(3,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}urea
Chemical Structure Depiction of
N'-tert-butyl-N-[(3-chlorophenyl)methyl]-N-{[3-(3,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}urea
N'-tert-butyl-N-[(3-chlorophenyl)methyl]-N-{[3-(3,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}urea
Compound characteristics
| Compound ID: | V001-8591 |
| Compound Name: | N'-tert-butyl-N-[(3-chlorophenyl)methyl]-N-{[3-(3,4-dimethoxyphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}urea |
| Molecular Weight: | 459.97 |
| Molecular Formula: | C24 H30 Cl N3 O4 |
| Smiles: | CC(C)(C)NC(N(CC1CC(c2ccc(c(c2)OC)OC)=NO1)Cc1cccc(c1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7892 |
| logD: | 4.7892 |
| logSw: | -4.9523 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.513 |
| InChI Key: | PYPCTYOQDXOYHO-LJQANCHMSA-N |