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Home > Indoles and Oxindole > 16036-25-2
16036-25-2 | 1-[2-(1H-indol-3-yl)ethyl]-3-propylurea
CAS No: 16036-25-2 Catalog No: AG00ITJS MDL No:MFCD02662312
Product Description
Catalog Number:
AG00ITJS
Chemical Name:
1-[2-(1H-indol-3-yl)ethyl]-3-propylurea
CAS Number:
16036-25-2
Molecular Formula:
C14H19N3O
Molecular Weight:
245.3202
MDL Number:
MFCD02662312
IUPAC Name:
1-[2-(1H-indol-3-yl)ethyl]-3-propylurea
InChI:
InChI=1S/C14H19N3O/c1-2-8-15-14(18)16-9-7-11-10-17-13-6-4-3-5-12(11)13/h3-6,10,17H,2,7-9H2,1H3,(H2,15,16,18)
InChI Key:
WTIASEFLGMEIDF-UHFFFAOYSA-N
SMILES:
CCCNC(=O)NCCc1c[nH]c2c1cccc2
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.153g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
245.326g/mol
Monoisotopic Mass:
245.153g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
56.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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