N-{3-[(4-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)methyl]-1,3-thiazol-2(3H)-ylidene}-3,4-dimethoxybenzamide
Chemical Structure Depiction of
N-{3-[(4-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)methyl]-1,3-thiazol-2(3H)-ylidene}-3,4-dimethoxybenzamide
N-{3-[(4-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)methyl]-1,3-thiazol-2(3H)-ylidene}-3,4-dimethoxybenzamide
Compound characteristics
| Compound ID: | V026-3158 |
| Compound Name: | N-{3-[(4-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)methyl]-1,3-thiazol-2(3H)-ylidene}-3,4-dimethoxybenzamide |
| Molecular Weight: | 505.57 |
| Molecular Formula: | C27 H24 F N3 O4 S |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1OC)C(/N=C1/N(Cc2ccc(cc2)C(NCc2ccc(cc2)F)=O)C=CS1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0307 |
| logD: | 3.0306 |
| logSw: | -3.4057 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.544 |
| InChI Key: | TWLRTJPCASNAFM-UHFFFAOYSA-N |