N-(4-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}phenyl)-5-[(4-fluorophenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}phenyl)-5-[(4-fluorophenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
N-(4-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}phenyl)-5-[(4-fluorophenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F913-1234 |
| Compound Name: | N-(4-{[2-(cyclohex-1-en-1-yl)ethyl]carbamoyl}phenyl)-5-[(4-fluorophenoxy)methyl]-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 480.56 |
| Molecular Formula: | C25 H25 F N4 O3 S |
| Smiles: | C1CCC(CCNC(c2ccc(cc2)NC(c2nnc(COc3ccc(cc3)F)s2)=O)=O)=CC1 |
| Stereo: | ACHIRAL |
| logP: | 4.1095 |
| logD: | 4.1028 |
| logSw: | -4.2253 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.004 |
| InChI Key: | BQDKSSJONMKZLC-UHFFFAOYSA-N |