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Home > Indoles and Oxindole > 827015-58-7
827015-58-7 | 1H-Indole, 3-[(4-phenyl-1-piperidinyl)methyl]-2-(2-thienyl)-
CAS No: 827015-58-7 Catalog No: AG0051SC MDL No:
Product Description
Catalog Number:
AG0051SC
Chemical Name:
1H-Indole, 3-[(4-phenyl-1-piperidinyl)methyl]-2-(2-thienyl)-
CAS Number:
827015-58-7
Molecular Formula:
C24H24N2S
Molecular Weight:
372.5258
IUPAC Name:
3-[(4-phenylpiperidin-1-yl)methyl]-2-thiophen-2-yl-1H-indole
InChI:
InChI=1S/C24H24N2S/c1-2-7-18(8-3-1)19-12-14-26(15-13-19)17-21-20-9-4-5-10-22(20)25-24(21)23-11-6-16-27-23/h1-11,16,19,25H,12-15,17H2
InChI Key:
OMUOZXJTXNIKJG-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1CCN(CC1)Cc1c([nH]c2c1cccc2)c1cccs1
Properties
Complexity:
469
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
372.166g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
372.53g/mol
Monoisotopic Mass:
372.166g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
47.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.5
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