1-(4-fluorophenyl)-N-(2-methoxyphenyl)-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbothioamide
Chemical Structure Depiction of
1-(4-fluorophenyl)-N-(2-methoxyphenyl)-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbothioamide
1-(4-fluorophenyl)-N-(2-methoxyphenyl)-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbothioamide
Compound characteristics
Compound ID: | K416-0008 |
Compound Name: | 1-(4-fluorophenyl)-N-(2-methoxyphenyl)-3,4-dihydropyrrolo[1,2-a]pyrazine-2(1H)-carbothioamide |
Molecular Weight: | 381.47 |
Molecular Formula: | C21 H20 F N3 O S |
Smiles: | [H]N(C(N1CCn2cccc2C1c1ccc(cc1)F)=S)c1ccccc1OC |
Stereo: | RACEMIC MIXTURE |
logP: | 4.9543 |
logD: | 4.9543 |
logSw: | -4.6016 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 19.5435 |
InChI Key: | AHUREZSVRXHPNH-HXUWFJFHSA-N |