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 |