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240799-55-7 | 1,3-bis(5-methyl-3-phenyl-1,2-oxazol-4-yl)urea
CAS No: 240799-55-7 Catalog No: AG00IMT3 MDL No:MFCD00119620
Product Description
Catalog Number:
AG00IMT3
Chemical Name:
1,3-bis(5-methyl-3-phenyl-1,2-oxazol-4-yl)urea
CAS Number:
240799-55-7
Molecular Formula:
C21H18N4O3
Molecular Weight:
374.3926
MDL Number:
MFCD00119620
IUPAC Name:
1,3-bis(5-methyl-3-phenyl-1,2-oxazol-4-yl)urea
InChI:
InChI=1S/C21H18N4O3/c1-13-17(19(24-27-13)15-9-5-3-6-10-15)22-21(26)23-18-14(2)28-25-20(18)16-11-7-4-8-12-16/h3-12H,1-2H3,(H2,22,23,26)
InChI Key:
UXNRZRDQHDHVAN-UHFFFAOYSA-N
SMILES:
O=C(Nc1c(C)onc1c1ccccc1)Nc1c(C)onc1c1ccccc1
Properties
Complexity:
478
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.138g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
374.4g/mol
Monoisotopic Mass:
374.138g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
93.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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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