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89399-92-8 | 2-Phenyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-amine
CAS No: 89399-92-8 Catalog No: AG003WJK MDL No:MFCD07339545
Product Description
Catalog Number:
AG003WJK
Chemical Name:
2-Phenyl-2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-amine
CAS Number:
89399-92-8
Molecular Formula:
C12H13N3
Molecular Weight:
199.2517
MDL Number:
MFCD07339545
IUPAC Name:
2-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazol-3-amine
InChI:
InChI=1S/C12H13N3/c13-12-10-7-4-8-11(10)14-15(12)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8,13H2
InChI Key:
VUBNLJXWVXGFSH-UHFFFAOYSA-N
SMILES:
Nc1n(nc2c1CCC2)c1ccccc1
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.111g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
199.257g/mol
Monoisotopic Mass:
199.111g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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 |
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