N-(4-{[(4-butoxyphenyl)methyl]carbamoyl}phenyl)-5-(phenoxymethyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-{[(4-butoxyphenyl)methyl]carbamoyl}phenyl)-5-(phenoxymethyl)-1,3,4-thiadiazole-2-carboxamide
N-(4-{[(4-butoxyphenyl)methyl]carbamoyl}phenyl)-5-(phenoxymethyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F913-0291 |
| Compound Name: | N-(4-{[(4-butoxyphenyl)methyl]carbamoyl}phenyl)-5-(phenoxymethyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 516.62 |
| Molecular Formula: | C28 H28 N4 O4 S |
| Smiles: | CCCCOc1ccc(CNC(c2ccc(cc2)NC(c2nnc(COc3ccccc3)s2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1803 |
| logD: | 5.1735 |
| logSw: | -4.9086 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.388 |
| InChI Key: | PIBYPPFAFCLGJB-UHFFFAOYSA-N |