2-chloro-N-[4,5-dimethyl-3-{[5-(pyrrolidine-1-carbonyl)furan-2-yl]methyl}-1,3-thiazol-2(3H)-ylidene]benzamide
Chemical Structure Depiction of
2-chloro-N-[4,5-dimethyl-3-{[5-(pyrrolidine-1-carbonyl)furan-2-yl]methyl}-1,3-thiazol-2(3H)-ylidene]benzamide
2-chloro-N-[4,5-dimethyl-3-{[5-(pyrrolidine-1-carbonyl)furan-2-yl]methyl}-1,3-thiazol-2(3H)-ylidene]benzamide
Compound characteristics
| Compound ID: | V027-2115 |
| Compound Name: | 2-chloro-N-[4,5-dimethyl-3-{[5-(pyrrolidine-1-carbonyl)furan-2-yl]methyl}-1,3-thiazol-2(3H)-ylidene]benzamide |
| Molecular Weight: | 443.95 |
| Molecular Formula: | C22 H22 Cl N3 O3 S |
| Salt: | not_available |
| Smiles: | CC1=C(C)SC(=N/C(c2ccccc2[Cl])=O)\N1Cc1ccc(C(N2CCCC2)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.9772 |
| logD: | 3.9772 |
| logSw: | -4.3257 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.615 |
| InChI Key: | KMFAWHVNUTYHGR-UHFFFAOYSA-N |