N-(3-chlorophenyl)-5-(4-{[(furan-2-yl)methyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-(4-{[(furan-2-yl)methyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-(4-{[(furan-2-yl)methyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0427 |
| Compound Name: | N-(3-chlorophenyl)-5-(4-{[(furan-2-yl)methyl]amino}-4-oxobutyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 404.87 |
| Molecular Formula: | C18 H17 Cl N4 O3 S |
| Smiles: | C(CC(NCc1ccco1)=O)Cc1nnc(C(Nc2cccc(c2)[Cl])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.3339 |
| logD: | 3.3307 |
| logSw: | -3.7114 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.278 |
| InChI Key: | ZAHQTHGMYIYWKM-UHFFFAOYSA-N |