N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-chloro-N-{[5-(3,4,5-trimethoxyphenyl)-1,2-oxazol-3-yl]methyl}benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-chloro-N-{[5-(3,4,5-trimethoxyphenyl)-1,2-oxazol-3-yl]methyl}benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-chloro-N-{[5-(3,4,5-trimethoxyphenyl)-1,2-oxazol-3-yl]methyl}benzamide
Compound characteristics
| Compound ID: | V004-6039 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-chloro-N-{[5-(3,4,5-trimethoxyphenyl)-1,2-oxazol-3-yl]methyl}benzamide |
| Molecular Weight: | 536.97 |
| Molecular Formula: | C28 H25 Cl N2 O7 |
| Smiles: | COc1cc(cc(c1OC)OC)c1cc(CN(Cc2ccc3c(c2)OCO3)C(c2ccc(cc2)[Cl])=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.8352 |
| logD: | 4.8352 |
| logSw: | -4.9157 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 78.302 |
| InChI Key: | UKPFHKABLGZGLM-UHFFFAOYSA-N |