Product Information
Chemical Formula: | C29H37N5O3 |
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Molecular Weight: | 503.64 |
Synonyms: | Xl888; 5-((R)-Sec-Butylamino)-N1-((1R,3R,5S)-8-(5-(Cyclopropanecarbonyl)Pyridin-2-Yl)-8-Azabicyclo[3.2.1]Octan-3-Yl)-2-Methylterephthalamide; N1-[(3-Endo)-8-[5-(Cyclopropylcarbonyl)-2-Pyridinyl]-8-Azabicyclo[3.2.1]Oct-3-Yl]-2-Methyl-5-[[(1R)-1-Methylpropyl]Amino]-1,4-Benzenedicarboxamide; 1,4-Benzenedicarboxamide, N1-[(3-Endo)-8-[5-(Cyclopropylcarbonyl)-2-Pyridinyl]-8-Azabicyclo[3.2.1]Oct-3-Yl]-2-Methyl-5-[[(1R)-1-Methylpropyl]Amino]-; Xl 888, >=98% |
MDL No.: | MFCD22124888 |
EINECS / EC No.: | N/A |
Pubchem CID: | 57748689 |
IUPAC Name: | 2-[[(2R)-butan-2-yl]amino]-4-N-[8-[5-(cyclopropanecarbonyl)pyridin-2-yl]-8-azabicyclo[3.2.1]octan-3-yl]-5-methylbenzene-1,4-dicarboxamide |
Standard InchI: | InChI=1S/C29H37N5O3/c1-4-17(3)32-25-14-23(16(2)11-24(25)28(30)36)29(37)33-20-12-21-8-9-22(13-20)34(21)26-10-7-19(15-31-26)27(35)18-5-6-18/h7,10-11,14-15,17-18,20-22,32H,4-6,8-9,12-13H2,1-3H3,(H2,30,36)(H,33,37)/t17-,20?,21?,22?/m1/s1 |
InchI Key: | LHGWWAFKVCIILM-LAQKFSSHSA-N |
SMILES: | CCC(C)NC1=C(C=C(C(=C1)C(=O)NC2CC3CCC(C2)N3C4=NC=C(C=C4)C(=O)C5CC5)C)C(=O)N |
Appearance: | - |
Melting Point: | N/A |
Boiling Point: | N/A |
Density (Theoretical): | N/A |
Safety Information
Signal Word: | Warning |
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Hazard Statements: | H302-H315-H319-H335 |
Precautionary Statements: | P261-P305+P351+P338 |
Transportation Information: | N/A |
GHS Pictograms: |