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1257391-86-8 | 7H-Pyrrolo[2,3-d]pyrimidine, 4-chloro-6-(4-methylphenyl)-7-phenyl-
CAS No: 1257391-86-8 Catalog No: AG000OLO MDL No:
Product Description
Catalog Number:
AG000OLO
Chemical Name:
7H-Pyrrolo[2,3-d]pyrimidine, 4-chloro-6-(4-methylphenyl)-7-phenyl-
CAS Number:
1257391-86-8
Molecular Formula:
C19H14ClN3
Molecular Weight:
319.7876
IUPAC Name:
4-chloro-6-(4-methylphenyl)-7-phenylpyrrolo[2,3-d]pyrimidine
InChI:
InChI=1S/C19H14ClN3/c1-13-7-9-14(10-8-13)17-11-16-18(20)21-12-22-19(16)23(17)15-5-3-2-4-6-15/h2-12H,1H3
InChI Key:
LZHJDIYFXCANIG-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)c1cc2c(n1c1ccccc1)ncnc2Cl
Properties
Complexity:
390
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.088g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
319.792g/mol
Monoisotopic Mass:
319.088g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
Literature
| Title | Journal |
|---|---|
| Synthesis of new pyrrolo[2,3-d]pyrimidine derivatives as antibacterial and antifungal agents. | European journal of medicinal chemistry 20101101 |
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