methyl 2-[2-(4,5-dibenzoyl-1H-1,2,3-triazol-1-yl)acetamido]benzoate
Chemical Structure Depiction of
methyl 2-[2-(4,5-dibenzoyl-1H-1,2,3-triazol-1-yl)acetamido]benzoate
methyl 2-[2-(4,5-dibenzoyl-1H-1,2,3-triazol-1-yl)acetamido]benzoate
Compound characteristics
| Compound ID: | Y500-3515 |
| Compound Name: | methyl 2-[2-(4,5-dibenzoyl-1H-1,2,3-triazol-1-yl)acetamido]benzoate |
| Molecular Weight: | 468.47 |
| Molecular Formula: | C26 H20 N4 O5 |
| Smiles: | COC(c1ccccc1NC(Cn1c(C(c2ccccc2)=O)c(C(c2ccccc2)=O)nn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4808 |
| logD: | 3.4722 |
| logSw: | -3.8094 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.534 |
| InChI Key: | LXSZGYCWZNBQRT-UHFFFAOYSA-N |