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887202-25-7 | 4-Chloro-7-(3-chloro-4-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine
CAS No: 887202-25-7 Catalog No: AG01FMR7 MDL No:MFCD03030412
Product Description
Catalog Number:
AG01FMR7
Chemical Name:
4-Chloro-7-(3-chloro-4-methylphenyl)-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine
CAS Number:
887202-25-7
Molecular Formula:
C19H13Cl2N3
Molecular Weight:
354.2326
MDL Number:
MFCD03030412
IUPAC Name:
4-chloro-7-(3-chloro-4-methylphenyl)-5-phenylpyrrolo[2,3-d]pyrimidine
InChI:
InChI=1S/C19H13Cl2N3/c1-12-7-8-14(9-16(12)20)24-10-15(13-5-3-2-4-6-13)17-18(21)22-11-23-19(17)24/h2-11H,1H3
InChI Key:
BIHBLVNFSLHIPN-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1Cl)n1cc(c2c1ncnc2Cl)c1ccccc1
Properties
Complexity:
429
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.049g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
354.234g/mol
Monoisotopic Mass:
353.049g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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