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Home > Aldehydes > 433955-84-1
433955-84-1 | 2-METHYL-1-[2-(4-METHYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-1H-INDOLE-3-CARBALDEHYDE
CAS No: 433955-84-1 Catalog No: AG0073XD MDL No:MFCD03216650
Product Description
Catalog Number:
AG0073XD
Chemical Name:
2-METHYL-1-[2-(4-METHYL-PIPERIDIN-1-YL)-2-OXO-ETHYL]-1H-INDOLE-3-CARBALDEHYDE
CAS Number:
433955-84-1
Molecular Formula:
C18H22N2O2
Molecular Weight:
298.3795
MDL Number:
MFCD03216650
IUPAC Name:
2-methyl-1-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]indole-3-carbaldehyde
InChI:
InChI=1S/C18H22N2O2/c1-13-7-9-19(10-8-13)18(22)11-20-14(2)16(12-21)15-5-3-4-6-17(15)20/h3-6,12-13H,7-11H2,1-2H3
InChI Key:
BOKFPTPAAQLKSQ-UHFFFAOYSA-N
SMILES:
O=Cc1c(C)n(c2c1cccc2)CC(=O)N1CCC(CC1)C
Properties
Complexity:
417
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.168g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.386g/mol
Monoisotopic Mass:
298.168g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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