N-[2-(3,4-dimethoxyphenyl)ethyl]-6-{[(4-fluorophenyl)methyl]sulfanyl}benzimidazo[1,2-c]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-{[(4-fluorophenyl)methyl]sulfanyl}benzimidazo[1,2-c]quinazoline-3-carboxamide
N-[2-(3,4-dimethoxyphenyl)ethyl]-6-{[(4-fluorophenyl)methyl]sulfanyl}benzimidazo[1,2-c]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | K250-0196 |
| Compound Name: | N-[2-(3,4-dimethoxyphenyl)ethyl]-6-{[(4-fluorophenyl)methyl]sulfanyl}benzimidazo[1,2-c]quinazoline-3-carboxamide |
| Molecular Weight: | 566.65 |
| Molecular Formula: | C32 H27 F N4 O3 S |
| Smiles: | COc1ccc(CCNC(c2ccc3c(c2)nc(n2c4ccccc4nc23)SCc2ccc(cc2)F)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 5.7126 |
| logD: | 5.7116 |
| logSw: | -5.6477 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.334 |
| InChI Key: | SKKSSUDIZIMLHO-UHFFFAOYSA-N |