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88914-36-7 | N-[3-DIMETHYLAMINO-4-[(4-METHOXYACRIDIN-9-YL)AMINO]PHENYL]METHANESULFONAMIDE
CAS No: 88914-36-7 Catalog No: AG00490M MDL No:
Product Description
Catalog Number:
AG00490M
Chemical Name:
N-[3-DIMETHYLAMINO-4-[(4-METHOXYACRIDIN-9-YL)AMINO]PHENYL]METHANESULFONAMIDE
CAS Number:
88914-36-7
Molecular Formula:
C23H24N4O3S
Molecular Weight:
436.5267
IUPAC Name:
N-[3-(dimethylamino)-4-[(4-methoxyacridin-9-yl)amino]phenyl]methanesulfonamide
InChI:
InChI=1S/C23H24N4O3S/c1-27(2)20-14-15(26-31(4,28)29)12-13-19(20)25-22-16-8-5-6-10-18(16)24-23-17(22)9-7-11-21(23)30-3/h5-14,26H,1-4H3,(H,24,25)
InChI Key:
RKUBDCCTOSDWKU-UHFFFAOYSA-N
SMILES:
COc1cccc2c1nc1ccccc1c2Nc1ccc(cc1N(C)C)NS(=O)(=O)C
Properties
Complexity:
697
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
436.157g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
436.53g/mol
Monoisotopic Mass:
436.157g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
91.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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