3,4-dichloro-N-[4,5-dimethyl-3-{[5-(pyrrolidine-1-carbonyl)furan-2-yl]methyl}-1,3-thiazol-2(3H)-ylidene]benzamide
Chemical Structure Depiction of
3,4-dichloro-N-[4,5-dimethyl-3-{[5-(pyrrolidine-1-carbonyl)furan-2-yl]methyl}-1,3-thiazol-2(3H)-ylidene]benzamide
3,4-dichloro-N-[4,5-dimethyl-3-{[5-(pyrrolidine-1-carbonyl)furan-2-yl]methyl}-1,3-thiazol-2(3H)-ylidene]benzamide
Compound characteristics
| Compound ID: | V029-1879 |
| Compound Name: | 3,4-dichloro-N-[4,5-dimethyl-3-{[5-(pyrrolidine-1-carbonyl)furan-2-yl]methyl}-1,3-thiazol-2(3H)-ylidene]benzamide |
| Molecular Weight: | 478.4 |
| Molecular Formula: | C22 H21 Cl2 N3 O3 S |
| Smiles: | CC1=C(C)SC(=N/C(c2ccc(c(c2)[Cl])[Cl])=O)\N1Cc1ccc(C(N2CCCC2)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.861 |
| logD: | 4.861 |
| logSw: | -4.934 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.615 |
| InChI Key: | BWOPVJYHKPEQIS-LVWGJNHUSA-N |