N-(4-{[(3-bromophenyl)methyl]carbamoyl}phenyl)-5-propyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-{[(3-bromophenyl)methyl]carbamoyl}phenyl)-5-propyl-1,3,4-thiadiazole-2-carboxamide
N-(4-{[(3-bromophenyl)methyl]carbamoyl}phenyl)-5-propyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F735-0650 |
| Compound Name: | N-(4-{[(3-bromophenyl)methyl]carbamoyl}phenyl)-5-propyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 459.36 |
| Molecular Formula: | C20 H19 Br N4 O2 S |
| Smiles: | CCCc1nnc(C(Nc2ccc(cc2)C(NCc2cccc(c2)[Br])=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.2336 |
| logD: | 4.2269 |
| logSw: | -4.3024 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.742 |
| InChI Key: | YDKIUIPHEHYUMX-UHFFFAOYSA-N |