N-{3-[(3-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)methyl]-4-methyl-1,3-thiazol-2(3H)-ylidene}-3-methoxybenzamide
Chemical Structure Depiction of
N-{3-[(3-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)methyl]-4-methyl-1,3-thiazol-2(3H)-ylidene}-3-methoxybenzamide
N-{3-[(3-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)methyl]-4-methyl-1,3-thiazol-2(3H)-ylidene}-3-methoxybenzamide
Compound characteristics
| Compound ID: | V014-0345 |
| Compound Name: | N-{3-[(3-{[(4-fluorophenyl)methyl]carbamoyl}phenyl)methyl]-4-methyl-1,3-thiazol-2(3H)-ylidene}-3-methoxybenzamide |
| Molecular Weight: | 489.57 |
| Molecular Formula: | C27 H24 F N3 O3 S |
| Smiles: | CC1=CSC(=N/C(c2cccc(c2)OC)=O)\N1Cc1cccc(c1)C(NCc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5578 |
| logD: | 4.5576 |
| logSw: | -4.4715 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.302 |
| InChI Key: | GTIPLCPSIPYVJO-UHFFFAOYSA-N |