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1196662-07-3 | 5-Iodo-7-(phenylsulfonyl)-7H-Pyrrolo[2,3-d]pyrimidine
CAS No: 1196662-07-3 Catalog No: AG00HF3H MDL No:
Product Description
Catalog Number:
AG00HF3H
Chemical Name:
5-Iodo-7-(phenylsulfonyl)-7H-Pyrrolo[2,3-d]pyrimidine
CAS Number:
1196662-07-3
IUPAC Name:
7-(benzenesulfonyl)-5-iodopyrrolo[2,3-d]pyrimidine
InChI:
InChI=1S/C12H8IN3O2S/c13-11-7-16(12-10(11)6-14-8-15-12)19(17,18)9-4-2-1-3-5-9/h1-8H
InChI Key:
AHDBGGPTLJKPCA-UHFFFAOYSA-N
Properties
Complexity:
419
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
384.938g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
385.179g/mol
Monoisotopic Mass:
384.938g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
73.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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