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Home > Indoles and Oxindole > 1181458-58-1
1181458-58-1 | tert-butyl N-[1-(1H-indol-3-ylmethyl)piperidin-4-yl]carbamate
CAS No: 1181458-58-1 Catalog No: AG019VDL MDL No:MFCD12197133
Product Description
Catalog Number:
AG019VDL
Chemical Name:
tert-butyl N-[1-(1H-indol-3-ylmethyl)piperidin-4-yl]carbamate
CAS Number:
1181458-58-1
Molecular Formula:
C19H27N3O2
Molecular Weight:
329.4366
MDL Number:
MFCD12197133
IUPAC Name:
tert-butyl N-[1-(1H-indol-3-ylmethyl)piperidin-4-yl]carbamate
InChI:
InChI=1S/C19H27N3O2/c1-19(2,3)24-18(23)21-15-8-10-22(11-9-15)13-14-12-20-17-7-5-4-6-16(14)17/h4-7,12,15,20H,8-11,13H2,1-3H3,(H,21,23)
InChI Key:
UQJNAVAVPRBBMW-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NC1CCN(CC1)Cc1c[nH]c2c1cccc2
Properties
Complexity:
427
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.21g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
329.444g/mol
Monoisotopic Mass:
329.21g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
57.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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