5-(4-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-4-oxobutyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-(4-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-4-oxobutyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-(4-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-4-oxobutyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F501-0687 |
| Compound Name: | 5-(4-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-4-oxobutyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 398.53 |
| Molecular Formula: | C21 H26 N4 O2 S |
| Smiles: | C1CCC(CCNC(CCCc2nnc(C(Nc3ccccc3)=O)s2)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 2.7832 |
| logD: | 2.7831 |
| logSw: | -3.4303 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.563 |
| InChI Key: | KHPGSQFGOVWHJP-UHFFFAOYSA-N |