3-chloro-N-[3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-4-methyl-1,3-thiazol-2(3H)-ylidene]benzamide
Chemical Structure Depiction of
3-chloro-N-[3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-4-methyl-1,3-thiazol-2(3H)-ylidene]benzamide
3-chloro-N-[3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-4-methyl-1,3-thiazol-2(3H)-ylidene]benzamide
Compound characteristics
| Compound ID: | V007-3161 |
| Compound Name: | 3-chloro-N-[3-(2-{[(4-fluorophenyl)methyl]amino}-2-oxoethyl)-4-methyl-1,3-thiazol-2(3H)-ylidene]benzamide |
| Molecular Weight: | 417.89 |
| Molecular Formula: | C20 H17 Cl F N3 O2 S |
| Smiles: | CC1=CSC(=N/C(c2cccc(c2)[Cl])=O)\N1CC(NCc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6308 |
| logD: | 3.6308 |
| logSw: | -4.0122 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.816 |
| InChI Key: | POWGWZRITBCINM-UHFFFAOYSA-N |