N-[2-(3,4-dimethoxyphenyl)ethyl]-6-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}benzimidazo[1,2-c]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}benzimidazo[1,2-c]quinazoline-3-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}benzimidazo[1,2-c]quinazoline-3-carboxamide
Compound characteristics
Compound ID: | K250-0177 |
Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-6-{[2-(4-ethoxyanilino)-2-oxoethyl]sulfanyl}benzimidazo[1,2-c]quinazoline-3-carboxamide |
Molecular Weight: | 635.74 |
Molecular Formula: | C35 H33 N5 O5 S |
Smiles: | CCOc1ccc(cc1)NC(CSc1nc2cc(ccc2c2nc3ccccc3n12)C(NCCc1ccc(c(c1)OC)OC)=O)=O |
Stereo: | ACHIRAL |
logP: | 5.7279 |
logD: | 5.7275 |
logSw: | -5.6281 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 86.607 |
InChI Key: | YFIXVKQRCFYUFR-UHFFFAOYSA-N |