CAS 2206736-07-2: (2S)-4-[7-(8-Chloro-1-naphthalenyl)-5,6,7,8-tetrahydro-2-[2-(1-piperidinyl)ethoxy]pyrido[3,4-d]pyrimidin-4-yl]-1-(1-oxo-2-propen-1-yl)-2-piperazineacetonitrile

Description:The chemical substance with the name "(2S)-4-[7-(8-Chloro-1-naphthalenyl)-5,6,7,8-tetrahydro-2-[2-(1-piperidinyl)ethoxy]pyrido[3,4-d]pyrimidin-4-yl]-1-(1-oxo-2-propen-1-yl)-2-piperazineacetonitrile" and CAS number "2206736-07-2" is a complex organic compound characterized by its multi-cyclic structure and various functional groups. It features a chiral center, indicated by the (2S) designation, which suggests that it may exhibit stereoisomerism, potentially influencing its biological activity. The presence of a chloro substituent on the naphthalene moiety and the piperazine ring indicates potential interactions with biological targets, making it of interest in medicinal chemistry. The compound's structure includes a pyrido[3,4-d]pyrimidine core, which is often associated with pharmacological properties. Additionally, the presence of an acetonitrile group may enhance solubility and reactivity. Overall, this compound's intricate structure suggests it may have specific applications in drug development or as a research chemical, although detailed studies would be necessary to elucidate its properties and potential uses.

Formula:C₃₃H₃₈ClN₇O₂

InChI:InChI=1S/C33H38ClN7O2/c1-2-30(42)41-19-18-40(22-25(41)12-14-35)32-26-13-17-39(29-11-7-9-24-8-6-10-27(34)31(24)29)23-28(26)36-33(37-32)43-21-20-38-15-4-3-5-16-38/h2,6-11,25H,1,3-5,12-13,15-23H2/t25-/m0/s1

InChI key:InChIKey=XCJKUQVOWJDAQL-VWLOTQADSA-N

SMILES:N#CCC1N(C(=O)C=C)CCN(C2=NC(=NC3=C2CCN(C4=CC=CC=5C=CC=C(Cl)C54)C3)OCCN6CCCCC6)C1

Synonyms:
2-Piperazineacetonitrile, 4-[7-(8-chloro-1-naphthalenyl)-5,6,7,8-tetrahydro-2-[2-(1-piperidinyl)ethoxy]pyrido[3,4-d]pyrimidin-4-yl]-1-(1-oxo-2-propen-1-yl)-, (2S)-
(2S)-4-[7-(8-Chloro-1-naphthalenyl)-5,6,7,8-tetrahydro-2-[2-(1-piperidinyl)ethoxy]pyrido[3,4-d]pyrimidin-4-yl]-1-(1-oxo-2-propen-1-yl)-2-piperazineacetonitrile