methyl 2-[({5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}methyl)carbamamido]benzoate
Chemical Structure Depiction of
methyl 2-[({5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}methyl)carbamamido]benzoate
methyl 2-[({5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}methyl)carbamamido]benzoate
Compound characteristics
| Compound ID: | L062-0391 |
| Compound Name: | methyl 2-[({5-[(4-methoxyphenyl)carbamoyl]-1,3,4-thiadiazol-2-yl}methyl)carbamamido]benzoate |
| Molecular Weight: | 441.46 |
| Molecular Formula: | C20 H19 N5 O5 S |
| Smiles: | COC(c1ccccc1NC(NCc1nnc(C(Nc2ccc(cc2)OC)=O)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5641 |
| logD: | 2.5629 |
| logSw: | -3.2597 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 108.974 |
| InChI Key: | SIRHXWFFYABMPJ-UHFFFAOYSA-N |