6-amino-4-[2-(methylsulfanyl)ethyl]-3-(thiophen-2-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
6-amino-4-[2-(methylsulfanyl)ethyl]-3-(thiophen-2-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-4-[2-(methylsulfanyl)ethyl]-3-(thiophen-2-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
Compound ID: | 8015-2960 |
Compound Name: | 6-amino-4-[2-(methylsulfanyl)ethyl]-3-(thiophen-2-yl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
Molecular Weight: | 318.42 |
Molecular Formula: | C14 H14 N4 O S2 |
Smiles: | CSCCC1C(C#N)=C(N)Oc2c1c(c1cccs1)n[nH]2 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.2021 |
logD: | 2.202 |
logSw: | -2.4463 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 71.763 |
InChI Key: | UICRWRPTIDKAPK-MRVPVSSYSA-N |