N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[(2-oxo-2-phenylethyl)sulfanyl]benzimidazo[1,2-c]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[(2-oxo-2-phenylethyl)sulfanyl]benzimidazo[1,2-c]quinazoline-3-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[(2-oxo-2-phenylethyl)sulfanyl]benzimidazo[1,2-c]quinazoline-3-carboxamide
Compound characteristics
Compound ID: | K250-0171 |
Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-6-[(2-oxo-2-phenylethyl)sulfanyl]benzimidazo[1,2-c]quinazoline-3-carboxamide |
Molecular Weight: | 576.67 |
Molecular Formula: | C33 H28 N4 O4 S |
Smiles: | COc1ccc(CCNC(c2ccc3c(c2)nc(n2c4ccccc4nc23)SCC(c2ccccc2)=O)=O)cc1OC |
Stereo: | ACHIRAL |
logP: | 5.3811 |
logD: | 5.3807 |
logSw: | -5.6176 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 69.581 |
InChI Key: | TXVBNTQTPOHQKJ-UHFFFAOYSA-N |