N-[4-(dimethylamino)phenyl]-2-{[3-(3-methoxyphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4',5':4,5]pyrimido[1,6-a]benzimidazol-5-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-[4-(dimethylamino)phenyl]-2-{[3-(3-methoxyphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4',5':4,5]pyrimido[1,6-a]benzimidazol-5-yl]sulfanyl}acetamide
N-[4-(dimethylamino)phenyl]-2-{[3-(3-methoxyphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4',5':4,5]pyrimido[1,6-a]benzimidazol-5-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | K286-0405 |
| Compound Name: | N-[4-(dimethylamino)phenyl]-2-{[3-(3-methoxyphenyl)-2-sulfanylidene-2,3-dihydro[1,3]thiazolo[4',5':4,5]pyrimido[1,6-a]benzimidazol-5-yl]sulfanyl}acetamide |
| Molecular Weight: | 572.73 |
| Molecular Formula: | C28 H24 N6 O2 S3 |
| Smiles: | CN(C)c1ccc(cc1)NC(CSC1=NC2=C(c3nc4ccccc4n13)SC(N2c1cccc(c1)OC)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7011 |
| logD: | 5.6925 |
| logSw: | -5.3946 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.149 |
| InChI Key: | FCGBHYPPYIHMOT-UHFFFAOYSA-N |