1-[3-({[4-(butylamino)quinazolin-2-yl]sulfanyl}methyl)-4-methoxyphenyl]ethan-1-one
Chemical Structure Depiction of
1-[3-({[4-(butylamino)quinazolin-2-yl]sulfanyl}methyl)-4-methoxyphenyl]ethan-1-one
1-[3-({[4-(butylamino)quinazolin-2-yl]sulfanyl}methyl)-4-methoxyphenyl]ethan-1-one
Compound characteristics
| Compound ID: | K297-0227 |
| Compound Name: | 1-[3-({[4-(butylamino)quinazolin-2-yl]sulfanyl}methyl)-4-methoxyphenyl]ethan-1-one |
| Molecular Weight: | 395.52 |
| Molecular Formula: | C22 H25 N3 O2 S |
| Smiles: | CCCCNc1c2ccccc2nc(n1)SCc1cc(ccc1OC)C(C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5165 |
| logD: | 5.5154 |
| logSw: | -5.5699 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.419 |
| InChI Key: | JYQFZVKYVKFGLK-UHFFFAOYSA-N |