N-({4-[5-(furan-2-yl)-1H-1,2,3-triazol-1-yl]phenyl}carbamothioyl)adamantane-1-carboxamide
Chemical Structure Depiction of
N-({4-[5-(furan-2-yl)-1H-1,2,3-triazol-1-yl]phenyl}carbamothioyl)adamantane-1-carboxamide
N-({4-[5-(furan-2-yl)-1H-1,2,3-triazol-1-yl]phenyl}carbamothioyl)adamantane-1-carboxamide
Compound characteristics
| Compound ID: | K415-0374 |
| Compound Name: | N-({4-[5-(furan-2-yl)-1H-1,2,3-triazol-1-yl]phenyl}carbamothioyl)adamantane-1-carboxamide |
| Molecular Weight: | 447.56 |
| Molecular Formula: | C24 H25 N5 O2 S |
| Smiles: | C1C2CC3CC1CC(C2)(C3)C(NC(Nc1ccc(cc1)n1c(cnn1)c1ccco1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3844 |
| logD: | 5.3842 |
| logSw: | -5.5659 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.836 |
| InChI Key: | DYEWQFXIEBZBBE-UHFFFAOYSA-N |