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Home > Indoles and Oxindole > 1376297-77-6
1376297-77-6 | N-(1-ethyl-1H-indol-6-yl)-4-[(prop-2-enamido)methyl]benzamide
CAS No: 1376297-77-6 Catalog No: AG01FI2M MDL No:
Product Description
Catalog Number:
AG01FI2M
Chemical Name:
N-(1-ethyl-1H-indol-6-yl)-4-[(prop-2-enamido)methyl]benzamide
CAS Number:
1376297-77-6
Molecular Formula:
C21H21N3O2
Molecular Weight:
347.4103
IUPAC Name:
N-(1-ethylindol-6-yl)-4-[(prop-2-enoylamino)methyl]benzamide
InChI:
InChI=1S/C21H21N3O2/c1-3-20(25)22-14-15-5-7-17(8-6-15)21(26)23-18-10-9-16-11-12-24(4-2)19(16)13-18/h3,5-13H,1,4,14H2,2H3,(H,22,25)(H,23,26)
InChI Key:
VFSDGOBAYCXBDH-UHFFFAOYSA-N
SMILES:
C=CC(=O)NCc1ccc(cc1)C(=O)Nc1ccc2c(c1)n(CC)cc2
Properties
Complexity:
513
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
347.163g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
347.418g/mol
Monoisotopic Mass:
347.163g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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