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2327-17-5 | Urea, N-phenyl-N'-2-pyridinyl-
CAS No: 2327-17-5 Catalog No: AG002MQI MDL No:
Product Description
Catalog Number:
AG002MQI
Chemical Name:
Urea, N-phenyl-N'-2-pyridinyl-
CAS Number:
2327-17-5
Molecular Formula:
C12H11N3O
Molecular Weight:
213.2352
IUPAC Name:
1-phenyl-3-pyridin-2-ylurea
InChI:
InChI=1S/C12H11N3O/c16-12(14-10-6-2-1-3-7-10)15-11-8-4-5-9-13-11/h1-9H,(H2,13,14,15,16)
InChI Key:
FDMIXRXCYIIUDY-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccccn1)Nc1ccccc1
NSC Number:
5995
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
213.24g/mol
Monoisotopic Mass:
213.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| 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 |
| Structure-based generation of a new class of potent Cdk4 inhibitors: new de novo design strategy and library design. | Journal of medicinal chemistry 20011220 |
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