N-[(furan-2-yl)methyl]-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-[(furan-2-yl)methyl]-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-[(furan-2-yl)methyl]-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: | K286-0402 |
| Compound Name: | N-[(furan-2-yl)methyl]-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: | 533.65 |
| Molecular Formula: | C25 H19 N5 O3 S3 |
| Smiles: | COc1cccc(c1)N1C2=C(c3nc4ccccc4n3C(=N2)SCC(NCc2ccco2)=O)SC1=S |
| Stereo: | ACHIRAL |
| logP: | 5.043 |
| logD: | 5.0427 |
| logSw: | -4.7284 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.415 |
| InChI Key: | ZTBYTVLAPXABQX-UHFFFAOYSA-N |