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Structure
|
|
| Relationships |
Total Number of functionally related protein(s) :
120
Total Number of Articles : 464
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| PubChem |
49806720
|
| Molecular Formula |
C30H34N4O2 |
| SMILES |
CCC1=CC2=C(C=C1N3CCC(CC3)N4CCOCC4)C(C5=C(C2=O)C6=C(N5)C=C(C=C6)C#N)(C)C |
| InChI |
InChI=1S/C30H34N4O2/c1-4-20-16-23-24(17-26(20)34-9-7-21(8-10-34)33-11-13-36-14-12-33)30(2,3)29-27(28(23)35)22-6-5-19(18-31)15-25(22)32-29/h5-6,15-17,21,32H,4,7-14H2,1-3H3 |
| synonyms |
- Alectinib
- 1256580-46-7
- CH5424802
- CH 5424802
- AF-802
- RO5424802
- UNII-LIJ4CT1Z3Y
- AF802
- Alectinib (CH5424802)
- CH-5424802
- 9-ethyl-6,6-dimethyl-8-(4-morpholinopiperidin-1-yl)-11-oxo-6,11-dihydro-5H-benzo[b]carbazole-3-carbonitrile
- LIJ4CT1Z3Y
- AF 802
- RO-5424802
- 9-ethyl-6,6-dimethyl-8-(4-morpholin-4-ylpiperidin-1-yl)-11-oxo-5H-benzo[b]carbazole-3-carbonitrile
- CH5424802(Alectinib)
- 9-Ethyl-6,11-dihydro-6,6-dimethyl-8-[4-(4-morpholinyl)-1-piperidinyl]-11-oxo-5H-benzo[b]carbazole-3-carbonitrile
- 9-Ethyl-6,6-Dimethyl-8-[4-(Morpholin-4-Yl)piperidin-1-Yl]-11-Oxo-6,11-Dihydro-5h-Benzo[b]carbazole-3-Carbonitrile
- CHEMBL1738797
- CHEBI:90936
- ARQ-761
- DTXSID50154840
- 5H-Benzo[b]carbazole-3-carbonitrile, 9-ethyl-6,11-dihydro-6,6-dimethyl-8-[4-(4-morpholinyl)-1-piperidinyl]-11-oxo-
- 9-Ethyl-6,6-dimethyl-8-[4-(morpholin-4-yl)piperidin-1-yl]-11-oxo-5H-benzo[b]carbazole-3-carbonitrile
- CHEBI:62268
- Alectinib [INN]
- 5H-BENZO(B)CARBAZOLE-3-CARBONITRILE, 9-ETHYL-6,11-DIHYDRO-6,6-DIMETHYL-8-(4-(4-MORPHOLINYL)-1-PIPERIDINYL)-11-OXO-
- 9-ethyl-6,11-dihydro-6,6-dimethyl-8-(4-(4-morpholinyl)-1-piperidinyl)-11-oxo-5h-benzo(b)carbazole-3-carbonitrile
- Alectinib [USAN:INN]
- alectinibum
Click to show/hide the synonyms
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| Properties |
| Property |
Value |
| MW |
482.6 g/mol |
| HBD |
1 |
| HBA |
5 |
| Rotatable Bond Count |
3 |
| Exact Mass |
482.26817634 g/mol |
| Monoisotopic Mass |
482.26817634 g/mol |
| Heavy Atom Count |
36 |
| Isotope Atom Count |
0 |
| Atom Stereo Count |
0 |
| Covalent Unit Count |
1 |
| Complexity |
867 |
| xlogp |
5.2 |
| Topological Polar Surface Area |
72.4 |
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