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Home > Indoles and Oxindole > 1110820-96-6
1110820-96-6 | 1-[2-(1H-indol-3-yl)ethyl]-3-(prop-2-en-1-yl)urea
CAS No: 1110820-96-6 Catalog No: AG01C6KR MDL No:MFCD11784039
Product Description
Catalog Number:
AG01C6KR
Chemical Name:
1-[2-(1H-indol-3-yl)ethyl]-3-(prop-2-en-1-yl)urea
CAS Number:
1110820-96-6
Molecular Formula:
C14H17N3O
Molecular Weight:
243.3043
MDL Number:
MFCD11784039
IUPAC Name:
1-[2-(1H-indol-3-yl)ethyl]-3-prop-2-enylurea
InChI:
InChI=1S/C14H17N3O/c1-2-8-15-14(18)16-9-7-11-10-17-13-6-4-3-5-12(11)13/h2-6,10,17H,1,7-9H2,(H2,15,16,18)
InChI Key:
RJUYDMPXRZRBKP-UHFFFAOYSA-N
SMILES:
C=CCNC(=O)NCCc1c[nH]c2c1cccc2
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.137g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
243.31g/mol
Monoisotopic Mass:
243.137g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
56.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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