CAS 154619-51-9

Carbamic acid, N-[8-[(2R,6S)-2,6-dimethyl-4-morpholinyl]octyl]-, (3aS,8aR)-1,2,3,3a,8,8a-hexahydro-1,3a,8-trimethylpyrrolo[2,3-b]indol-5-yl ester

Description:

Carbamic acid, N-[8-[(2R,6S)-2,6-dimethyl-4-morpholinyl]octyl]-, (3aS,8aR)-1,2,3,3a,8,8a-hexahydro-1,3a,8-trimethylpyrrolo[2,3-b]indol-5-yl ester, with CAS number 154619-51-9, is a complex organic compound characterized by its unique structural features, including a carbamic acid functional group and a pyrroloindole moiety. This compound exhibits properties typical of carbamates, such as potential biological activity and the ability to form hydrogen bonds due to the presence of nitrogen and oxygen atoms. The morpholine ring contributes to its solubility and reactivity, while the octyl chain enhances hydrophobic interactions. Its stereochemistry, indicated by the specific configurations at various chiral centers, may influence its pharmacological properties, making it of interest in medicinal chemistry. The compound's stability, reactivity, and potential applications in drug development or as a biochemical tool would depend on its specific interactions with biological targets, which are often explored through in vitro and in vivo studies. Overall, this compound represents a fascinating area of study within organic and medicinal chemistry.

Formula: C₂₈H₄₆N₄O₃

InChI: InChI=1S/C28H46N4O3/c1-21-19-32(20-22(2)34-21)16-11-9-7-6-8-10-15-29-27(33)35-23-12-13-25-24(18-23)28(3)14-17-30(4)26(28)31(25)5/h12-13,18,21-22,26H,6-11,14-17,19-20H2,1-5H3,(H,29,33)/t21-,22+,26-,28+/m1/s1

InChI key: InChIKey=CJMJXTWMGXRFOM-FKTURHEWSA-N

SMILES: C[C@]12C=3C(N(C)[C@]1(N(C)CC2)[H])=CC=C(OC(NCCCCCCCCN4C[C@H](C)O[C@H](C)C4)=O)C3

Synonyms:

• Carbamic acid, N-[8-[(2R,6S)-2,6-dimethyl-4-morpholinyl]octyl]-, (3aS,8aR)-1,2,3,3a,8,8a-hexahydro-1,3a,8-trimethylpyrrolo[2,3-b]indol-5-yl ester
• MF 268
• Pyrrolo[2,3-b]indole, carbamic acid deriv.
• Carbamic acid, [8-[(2R,6S)-2,6-dimethyl-4-morpholinyl]octyl]-, (3aS,8aR)-1,2,3,3a,8,8a-hexahydro-1,3a,8-trimethylpyrrolo[2,3-b]indol-5-yl ester
• Carbamic acid, [8-(2,6-dimethyl-4-morpholinyl)octyl]-, 1,2,3,3a,8,8a-hexahydro-1,3a,8-trimethylpyrrolo[2,3-b]indol-5-yl ester, [3aS-[3aα,5(2R*,6S*),8aα]]-

Mf 268

CAS: 154619-51-9

Mf 268 is a pseudo-reversible carbamate-type inhibitor which interacts with the catalytic and regulatory anionic site of the enzyme.

Formula: C₂₈H₄₆N₄O₃

Color and Shape: Solid

Molecular weight: 486.69

Ref: TM-T70465