methyl 4-[2-({5-[(4-methoxyphenyl)carbamamido]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamido]benzoate
Chemical Structure Depiction of
methyl 4-[2-({5-[(4-methoxyphenyl)carbamamido]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamido]benzoate
methyl 4-[2-({5-[(4-methoxyphenyl)carbamamido]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamido]benzoate
Compound characteristics
| Compound ID: | G856-9841 |
| Compound Name: | methyl 4-[2-({5-[(4-methoxyphenyl)carbamamido]-1,3,4-thiadiazol-2-yl}sulfanyl)acetamido]benzoate |
| Molecular Weight: | 473.53 |
| Molecular Formula: | C20 H19 N5 O5 S2 |
| Smiles: | COC(c1ccc(cc1)NC(CSc1nnc(NC(Nc2ccc(cc2)OC)=O)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4482 |
| logD: | 4.448 |
| logSw: | -4.2141 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 107.043 |
| InChI Key: | WLDHNJPERZFFTL-UHFFFAOYSA-N |