N'-tert-butyl-N-[(3-chlorophenyl)methyl]-N-{[3-(3,4-dichlorophenyl)-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-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}urea
N'-tert-butyl-N-[(3-chlorophenyl)methyl]-N-{[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}urea
Compound characteristics
| Compound ID: | V026-1102 |
| Compound Name: | N'-tert-butyl-N-[(3-chlorophenyl)methyl]-N-{[3-(3,4-dichlorophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}urea |
| Molecular Weight: | 468.81 |
| Molecular Formula: | C22 H24 Cl3 N3 O2 |
| Salt: | not_available |
| Smiles: | CC(C)(C)NC(N(CC1CC(c2ccc(c(c2)[Cl])[Cl])=NO1)Cc1cccc(c1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.4491 |
| logD: | 6.449 |
| logSw: | -6.3769 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.252 |
| InChI Key: | OBGMHTJZHKREOG-KRWDZBQOSA-N |