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1174372-97-4 | Methanone, (4-chlorophenyl)[2,3-dihydro-2-(4-methoxyphenoxy)-3,3-dimethyl-1H-indol-1-yl]-
CAS No: 1174372-97-4 Catalog No: AG000EAW MDL No:
Product Description
Catalog Number:
AG000EAW
Chemical Name:
Methanone, (4-chlorophenyl)[2,3-dihydro-2-(4-methoxyphenoxy)-3,3-dimethyl-1H-indol-1-yl]-
CAS Number:
1174372-97-4
Molecular Formula:
C24H22ClNO3
Molecular Weight:
407.8894
IUPAC Name:
(4-chlorophenyl)-[2-(4-methoxyphenoxy)-3,3-dimethyl-2H-indol-1-yl]methanone
InChI:
InChI=1S/C24H22ClNO3/c1-24(2)20-6-4-5-7-21(20)26(22(27)16-8-10-17(25)11-9-16)23(24)29-19-14-12-18(28-3)13-15-19/h4-15,23H,1-3H3
InChI Key:
OVNBFZLWWWJMEG-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)OC1N(C(=O)c2ccc(cc2)Cl)c2c(C1(C)C)cccc2
Properties
Complexity:
567
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
407.129g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
407.894g/mol
Monoisotopic Mass:
407.129g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6.3
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