N-[4,5-dimethyl-3-{[2-(pyrrolidine-1-carbonyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]-4-methylbenzamide
Chemical Structure Depiction of
N-[4,5-dimethyl-3-{[2-(pyrrolidine-1-carbonyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]-4-methylbenzamide
N-[4,5-dimethyl-3-{[2-(pyrrolidine-1-carbonyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]-4-methylbenzamide
Compound characteristics
| Compound ID: | V007-3660 |
| Compound Name: | N-[4,5-dimethyl-3-{[2-(pyrrolidine-1-carbonyl)phenyl]methyl}-1,3-thiazol-2(3H)-ylidene]-4-methylbenzamide |
| Molecular Weight: | 433.57 |
| Molecular Formula: | C25 H27 N3 O2 S |
| Smiles: | CC1=C(C)SC(=N/C(c2ccc(C)cc2)=O)\N1Cc1ccccc1C(N1CCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5503 |
| logD: | 4.5503 |
| logSw: | -4.2925 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.774 |
| InChI Key: | XURIZAKYPSWJTL-UHFFFAOYSA-N |