5-[3-(butylamino)-3-oxopropyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[3-(butylamino)-3-oxopropyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
5-[3-(butylamino)-3-oxopropyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | G713-0825 |
| Compound Name: | 5-[3-(butylamino)-3-oxopropyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 362.45 |
| Molecular Formula: | C17 H22 N4 O3 S |
| Smiles: | CCCCNC(CCc1nnc(C(Nc2ccc(cc2)OC)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2535 |
| logD: | 2.2534 |
| logSw: | -2.9906 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.186 |
| InChI Key: | PLPKZKHKDCQCNC-UHFFFAOYSA-N |