2-chloro-N-[4,5-dimethyl-3-{[2-(pyrrolidine-1-carbonyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]benzamide
Chemical Structure Depiction of
2-chloro-N-[4,5-dimethyl-3-{[2-(pyrrolidine-1-carbonyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]benzamide
2-chloro-N-[4,5-dimethyl-3-{[2-(pyrrolidine-1-carbonyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]benzamide
Compound characteristics
| Compound ID: | V014-0371 |
| Compound Name: | 2-chloro-N-[4,5-dimethyl-3-{[2-(pyrrolidine-1-carbonyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]benzamide |
| Molecular Weight: | 453.99 |
| Molecular Formula: | C24 H24 Cl N3 O2 S |
| Smiles: | CC1=C(C)SC(=N/C(c2ccccc2[Cl])=O)\N1Cc1ccccc1C(N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4431 |
| logD: | 4.4431 |
| logSw: | -4.5729 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.774 |
| InChI Key: | GQAZWCQRAKDKRK-UHFFFAOYSA-N |