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 |