methyl 5-chloro-3-[[2-[(1S,9R)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl]acetyl]amino]-1H-indole-2-carboxylate
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methyl 5-chloro-3-[[2-[(1S,9R)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl]acetyl]amino]-1H-indole-2-carboxylate
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CAS No:
1212433-80-1
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Formula:
C23H23ClN4O4
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Chemical Name:
methyl 5-chloro-3-[[2-[(1S,9R)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl]acetyl]amino]-1H-indole-2-carboxylate
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Synonyms:
ZINC2097944;STL540000;AKOS037498384;MCULE-9456447024;1212433-80-1;methyl 5-chloro-3-({[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]acetyl}amino)-1H-indole-2-carboxylate
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CAS No:
methyl 5-chloro-3-[[2-[(1S,9R)-6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl]acetyl]amino]-1H-indole-2-carboxylate Basic Attributes
454.9 g/mol
454.1407829 g/mol
Computed Properties
Molecular Weight:454.9
XLogP3:3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:454.1407829
Monoisotopic Mass:454.1407829
Topological Polar Surface Area:94.7
Heavy Atom Count:32
Complexity:861
Defined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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