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1958821-59-4 | (S)-7-Chloro-1-(5-Chloro-4-Methoxy-2-Nitrophenyl)-6-Fluoro-3-Methyl-2,3,4,9-Tetrahydro-1H-Pyrido[3,4-B]Indole
CAS No: 1958821-59-4 Catalog No: AG01FLEL MDL No:MFCD28991994
Product Description
Catalog Number:
AG01FLEL
Chemical Name:
(S)-7-Chloro-1-(5-Chloro-4-Methoxy-2-Nitrophenyl)-6-Fluoro-3-Methyl-2,3,4,9-Tetrahydro-1H-Pyrido[3,4-B]Indole
CAS Number:
1958821-59-4
MDL Number:
MFCD28991994
IUPAC Name:
(3S)-7-chloro-1-(5-chloro-4-methoxy-2-nitrophenyl)-6-fluoro-3-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
InChI:
InChI=1S/C19H16Cl2FN3O3/c1-8-3-10-9-5-14(22)12(20)6-15(9)24-18(10)19(23-8)11-4-13(21)17(28-2)7-16(11)25(26)27/h4-8,19,23-24H,3H2,1-2H3/t8-,19?/m0/s1
InChI Key:
GKLVJGQIEHUUDF-LQABBHMDSA-N
Properties
Complexity:
597
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
423.055g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
424.253g/mol
Monoisotopic Mass:
423.055g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
82.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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