N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)sulfanyl]benzimidazo[1,2-c]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)sulfanyl]benzimidazo[1,2-c]quinazoline-3-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)sulfanyl]benzimidazo[1,2-c]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | K250-0193 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[(2-oxo-2-{[(oxolan-2-yl)methyl]amino}ethyl)sulfanyl]benzimidazo[1,2-c]quinazoline-3-carboxamide |
| Molecular Weight: | 599.71 |
| Molecular Formula: | C32 H33 N5 O5 S |
| Smiles: | COc1ccc(CCNC(c2ccc3c(c2)nc(n2c4ccccc4nc23)SCC(NCC2CCCO2)=O)=O)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4958 |
| logD: | 3.4954 |
| logSw: | -3.9494 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.46 |
| InChI Key: | CIEKPSSDODLIND-JOCHJYFZSA-N |