N-{[3-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-[(2-chlorophenyl)methyl]-N'-(propan-2-yl)urea
Chemical Structure Depiction of
N-{[3-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-[(2-chlorophenyl)methyl]-N'-(propan-2-yl)urea
N-{[3-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-[(2-chlorophenyl)methyl]-N'-(propan-2-yl)urea
Compound characteristics
| Compound ID: | V010-4327 |
| Compound Name: | N-{[3-(2H-1,3-benzodioxol-5-yl)-4,5-dihydro-1,2-oxazol-5-yl]methyl}-N-[(2-chlorophenyl)methyl]-N'-(propan-2-yl)urea |
| Molecular Weight: | 429.9 |
| Molecular Formula: | C22 H24 Cl N3 O4 |
| Smiles: | CC(C)NC(N(CC1CC(c2ccc3c(c2)OCO3)=NO1)Cc1ccccc1[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7539 |
| logD: | 4.7539 |
| logSw: | -4.9295 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.518 |
| InChI Key: | ZFVZLDRFVDPYNR-QGZVFWFLSA-N |