N-(3-chlorophenyl)-5-[(2-propylpentanamido)methyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-[(2-propylpentanamido)methyl]-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-[(2-propylpentanamido)methyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L061-0337 |
| Compound Name: | N-(3-chlorophenyl)-5-[(2-propylpentanamido)methyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 394.92 |
| Molecular Formula: | C18 H23 Cl N4 O2 S |
| Smiles: | CCCC(CCC)C(NCc1nnc(C(Nc2cccc(c2)[Cl])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6821 |
| logD: | 4.6788 |
| logSw: | -4.705 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 72.014 |
| InChI Key: | VFJVLQSBCOSHHD-UHFFFAOYSA-N |