methyl 6-sulfanylidene-5,6-dihydrobenzimidazo[1,2-c]quinazoline-3-carboxylate
Chemical Structure Depiction of
methyl 6-sulfanylidene-5,6-dihydrobenzimidazo[1,2-c]quinazoline-3-carboxylate
methyl 6-sulfanylidene-5,6-dihydrobenzimidazo[1,2-c]quinazoline-3-carboxylate
Compound characteristics
| Compound ID: | K284-1054 |
| Compound Name: | methyl 6-sulfanylidene-5,6-dihydrobenzimidazo[1,2-c]quinazoline-3-carboxylate |
| Molecular Weight: | 309.34 |
| Molecular Formula: | C16 H11 N3 O2 S |
| Smiles: | COC(c1ccc2c(c1)NC(n1c3ccccc3nc12)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4592 |
| logD: | 3.376 |
| logSw: | -3.9345 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.577 |
| InChI Key: | YVHLACWKRYLQAU-UHFFFAOYSA-N |