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Home > Imidazoles > 163565-07-9
163565-07-9 | Thiourea, N-[2-(1H-imidazol-5-yl)ethyl]-N'-(2-phenylethyl)-
CAS No: 163565-07-9 Catalog No: AG001U8C MDL No:
Product Description
Catalog Number:
AG001U8C
Chemical Name:
Thiourea, N-[2-(1H-imidazol-5-yl)ethyl]-N'-(2-phenylethyl)-
CAS Number:
163565-07-9
Molecular Formula:
C14H18N4S
Molecular Weight:
274.3845
IUPAC Name:
1-[2-(1H-imidazol-5-yl)ethyl]-3-(2-phenylethyl)thiourea
InChI:
InChI=1S/C14H18N4S/c19-14(17-9-7-13-10-15-11-18-13)16-8-6-12-4-2-1-3-5-12/h1-5,10-11H,6-9H2,(H,15,18)(H2,16,17,19)
InChI Key:
QXUWGMKTSYHKJQ-UHFFFAOYSA-N
SMILES:
S=C(NCCc1cnc[nH]1)NCCc1ccccc1
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.125g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
274.386g/mol
Monoisotopic Mass:
274.125g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
84.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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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