2-{[2,5-dimethoxy-4-(pyrrolidin-1-yl)phenyl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Chemical Structure Depiction of
2-{[2,5-dimethoxy-4-(pyrrolidin-1-yl)phenyl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
2-{[2,5-dimethoxy-4-(pyrrolidin-1-yl)phenyl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one
Compound characteristics
| Compound ID: | 6414-0730 |
| Compound Name: | 2-{[2,5-dimethoxy-4-(pyrrolidin-1-yl)phenyl]methylidene}[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one |
| Molecular Weight: | 407.49 |
| Molecular Formula: | C22 H21 N3 O3 S |
| Smiles: | COc1cc(c(cc1\C=C1/C(n2c3ccccc3nc2S1)=O)OC)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 4.5562 |
| logD: | 4.5562 |
| logSw: | -4.4152 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.231 |
| InChI Key: | BTVKCRHHJDNWTJ-UHFFFAOYSA-N |