5-(3-{[(3,4-dimethoxyphenyl)methyl]amino}-3-oxopropyl)-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-(3-{[(3,4-dimethoxyphenyl)methyl]amino}-3-oxopropyl)-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
5-(3-{[(3,4-dimethoxyphenyl)methyl]amino}-3-oxopropyl)-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | G713-0873 |
| Compound Name: | 5-(3-{[(3,4-dimethoxyphenyl)methyl]amino}-3-oxopropyl)-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 456.52 |
| Molecular Formula: | C22 H24 N4 O5 S |
| Smiles: | COc1ccc(cc1)NC(c1nnc(CCC(NCc2ccc(c(c2)OC)OC)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2147 |
| logD: | 2.2146 |
| logSw: | -3.0551 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.334 |
| InChI Key: | BPEKCQXNHPYEPF-UHFFFAOYSA-N |