3-{[5-fluoro-3'-(3-methylbutanoyl)-2-oxospiro[indole-3,2'-[1,3]thiazolidin]-1(2H)-yl]methyl}benzonitrile
Chemical Structure Depiction of
3-{[5-fluoro-3'-(3-methylbutanoyl)-2-oxospiro[indole-3,2'-[1,3]thiazolidin]-1(2H)-yl]methyl}benzonitrile
3-{[5-fluoro-3'-(3-methylbutanoyl)-2-oxospiro[indole-3,2'-[1,3]thiazolidin]-1(2H)-yl]methyl}benzonitrile
Compound characteristics
| Compound ID: | V024-1756 |
| Compound Name: | 3-{[5-fluoro-3'-(3-methylbutanoyl)-2-oxospiro[indole-3,2'-[1,3]thiazolidin]-1(2H)-yl]methyl}benzonitrile |
| Molecular Weight: | 423.51 |
| Molecular Formula: | C23 H22 F N3 O2 S |
| Smiles: | CC(C)CC(N1CCSC12C(N(Cc1cccc(C#N)c1)c1ccc(cc12)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2043 |
| logD: | 4.2043 |
| logSw: | -4.2672 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.38 |
| InChI Key: | ZLIMVBUNYFEBNT-QHCPKHFHSA-N |