N-(3-{[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-2-fluoro-N-propylbenzamide
Chemical Structure Depiction of
N-(3-{[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-2-fluoro-N-propylbenzamide
N-(3-{[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-2-fluoro-N-propylbenzamide
Compound characteristics
| Compound ID: | V025-4853 |
| Compound Name: | N-(3-{[5-(4-chlorophenyl)-1,3,4-thiadiazol-2-yl]amino}-3-oxopropyl)-2-fluoro-N-propylbenzamide |
| Molecular Weight: | 446.93 |
| Molecular Formula: | C21 H20 Cl F N4 O2 S |
| Salt: | not_available |
| Smiles: | CCCN(CCC(Nc1nnc(c2ccc(cc2)[Cl])s1)=O)C(c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4954 |
| logD: | 4.4951 |
| logSw: | -4.7438 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.829 |
| InChI Key: | OCTBXGNRQZWMKN-UHFFFAOYSA-N |