3,4-dichloro-N-{4,5-dimethyl-3-[1-oxo-1-(pyrrolidin-1-yl)butan-2-yl]-1,3-thiazol-2(3H)-ylidene}benzamide
Chemical Structure Depiction of
3,4-dichloro-N-{4,5-dimethyl-3-[1-oxo-1-(pyrrolidin-1-yl)butan-2-yl]-1,3-thiazol-2(3H)-ylidene}benzamide
3,4-dichloro-N-{4,5-dimethyl-3-[1-oxo-1-(pyrrolidin-1-yl)butan-2-yl]-1,3-thiazol-2(3H)-ylidene}benzamide
Compound characteristics
| Compound ID: | V005-2035 |
| Compound Name: | 3,4-dichloro-N-{4,5-dimethyl-3-[1-oxo-1-(pyrrolidin-1-yl)butan-2-yl]-1,3-thiazol-2(3H)-ylidene}benzamide |
| Molecular Weight: | 440.39 |
| Molecular Formula: | C20 H23 Cl2 N3 O2 S |
| Smiles: | CCC(C(N1CCCC1)=O)N1C(C)=C(C)SC/1=N/C(c1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5791 |
| logD: | 4.5791 |
| logSw: | -4.7061 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.971 |
| InChI Key: | APGWYBFXUHYWNM-DVCONVQISA-N |