5-{[(2,4-dimethoxyphenyl)carbamamido]methyl}-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{[(2,4-dimethoxyphenyl)carbamamido]methyl}-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
5-{[(2,4-dimethoxyphenyl)carbamamido]methyl}-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L062-0433 |
| Compound Name: | 5-{[(2,4-dimethoxyphenyl)carbamamido]methyl}-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 443.48 |
| Molecular Formula: | C20 H21 N5 O5 S |
| Smiles: | COc1ccc(cc1)NC(c1nnc(CNC(Nc2ccc(cc2OC)OC)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5847 |
| logD: | 2.5846 |
| logSw: | -3.2865 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 102.974 |
| InChI Key: | PNBQQOAAGSPFFI-UHFFFAOYSA-N |