N-{3-[(4-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)methyl]-1,3-thiazol-2(3H)-ylidene}-4-methylbenzamide
Chemical Structure Depiction of
N-{3-[(4-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)methyl]-1,3-thiazol-2(3H)-ylidene}-4-methylbenzamide
N-{3-[(4-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)methyl]-1,3-thiazol-2(3H)-ylidene}-4-methylbenzamide
Compound characteristics
| Compound ID: | V029-7807 |
| Compound Name: | N-{3-[(4-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)methyl]-1,3-thiazol-2(3H)-ylidene}-4-methylbenzamide |
| Molecular Weight: | 459.54 |
| Molecular Formula: | C26 H22 F N3 O2 S |
| Smiles: | Cc1ccc(cc1)C(/N=C1/N(Cc2ccc(cc2)C(NCc2ccc(cc2)F)=O)C=CS1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9139 |
| logD: | 3.9138 |
| logSw: | -3.9299 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.284 |
| InChI Key: | GDHSQFVSZMNNMQ-UHFFFAOYSA-N |