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Home > Indoles and Oxindole > 362502-79-2
362502-79-2 | 3-[2-(1H-indol-3-yl)ethyl]-1-(4-methoxyphenyl)thiourea
CAS No: 362502-79-2 Catalog No: AG00IXC5 MDL No:MFCD00955366
Product Description
Catalog Number:
AG00IXC5
Chemical Name:
3-[2-(1H-indol-3-yl)ethyl]-1-(4-methoxyphenyl)thiourea
CAS Number:
362502-79-2
Molecular Formula:
C18H19N3OS
Molecular Weight:
325.4280
MDL Number:
MFCD00955366
IUPAC Name:
1-[2-(1H-indol-3-yl)ethyl]-3-(4-methoxyphenyl)thiourea
InChI:
InChI=1S/C18H19N3OS/c1-22-15-8-6-14(7-9-15)21-18(23)19-11-10-13-12-20-17-5-3-2-4-16(13)17/h2-9,12,20H,10-11H2,1H3,(H2,19,21,23)
InChI Key:
USHGHTOQCIQMRQ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)NC(=S)NCCc1c[nH]c2c1cccc2
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.125g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
325.43g/mol
Monoisotopic Mass:
325.125g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
81.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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