N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)sulfanyl]benzimidazo[1,2-c]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)sulfanyl]benzimidazo[1,2-c]quinazoline-3-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)sulfanyl]benzimidazo[1,2-c]quinazoline-3-carboxamide
Compound characteristics
Compound ID: | K250-0179 |
Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[(2-{[(furan-2-yl)methyl]amino}-2-oxoethyl)sulfanyl]benzimidazo[1,2-c]quinazoline-3-carboxamide |
Molecular Weight: | 595.68 |
Molecular Formula: | C32 H29 N5 O5 S |
Smiles: | COc1ccc(CCNC(c2ccc3c(c2)nc(n2c4ccccc4nc23)SCC(NCc2ccco2)=O)=O)cc1OC |
Stereo: | ACHIRAL |
logP: | 4.7909 |
logD: | 4.7905 |
logSw: | -4.7057 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 88.554 |
InChI Key: | WBBDHAMYWIQRRV-UHFFFAOYSA-N |