(pyrrolidin-1-yl)(1-{2-[1-(thiophene-2-sulfonyl)piperidin-2-yl]ethyl}-1H-1,2,3-triazol-4-yl)methanone
Chemical Structure Depiction of
(pyrrolidin-1-yl)(1-{2-[1-(thiophene-2-sulfonyl)piperidin-2-yl]ethyl}-1H-1,2,3-triazol-4-yl)methanone
(pyrrolidin-1-yl)(1-{2-[1-(thiophene-2-sulfonyl)piperidin-2-yl]ethyl}-1H-1,2,3-triazol-4-yl)methanone
Compound characteristics
Compound ID: | T505-1727 |
Compound Name: | (pyrrolidin-1-yl)(1-{2-[1-(thiophene-2-sulfonyl)piperidin-2-yl]ethyl}-1H-1,2,3-triazol-4-yl)methanone |
Molecular Weight: | 423.55 |
Molecular Formula: | C18 H25 N5 O3 S2 |
Smiles: | C1CCN(C(C1)CCn1cc(C(N2CCCC2)=O)nn1)S(c1cccs1)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.0051 |
logD: | 2.0051 |
logSw: | -2.1841 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 76.897 |
InChI Key: | PJHNQCXMGYDUBC-OAHLLOKOSA-N |