N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-chloro-N-{[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl}benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-chloro-N-{[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl}benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-chloro-N-{[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl}benzamide
Compound characteristics
| Compound ID: | V004-5978 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-chloro-N-{[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl}benzamide |
| Molecular Weight: | 506.94 |
| Molecular Formula: | C27 H23 Cl N2 O6 |
| Smiles: | COc1ccc(cc1OC)c1cc(CN(Cc2ccc3c(c2)OCO3)C(c2ccc(cc2)[Cl])=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.7935 |
| logD: | 4.7935 |
| logSw: | -4.9221 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 70.585 |
| InChI Key: | KIUMVILDJFBAHP-UHFFFAOYSA-N |