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Home > Indoles and Oxindole > 917966-83-7
917966-83-7 | Thiourea, N-[2-(1H-indol-2-yl)phenyl]-
CAS No: 917966-83-7 Catalog No: AG006ME9 MDL No:
Product Description
Catalog Number:
AG006ME9
Chemical Name:
Thiourea, N-[2-(1H-indol-2-yl)phenyl]-
CAS Number:
917966-83-7
Molecular Formula:
C15H13N3S
Molecular Weight:
267.3488
IUPAC Name:
[2-(1H-indol-2-yl)phenyl]thiourea
InChI:
InChI=1S/C15H13N3S/c16-15(19)18-13-8-4-2-6-11(13)14-9-10-5-1-3-7-12(10)17-14/h1-9,17H,(H3,16,18,19)
InChI Key:
UPZLXYHZVCBKNQ-UHFFFAOYSA-N
SMILES:
NC(=S)Nc1ccccc1c1cc2c([nH]1)cccc2
Properties
Complexity:
333
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.083g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
267.35g/mol
Monoisotopic Mass:
267.083g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
85.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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