3-Amino-2,6-dimethyl-5-phenylthieno[2,3-d]pyrimidin-4-one - CAS 43088-53-5
Catalog: |
BB042802 |
Product Name: |
3-Amino-2,6-dimethyl-5-phenylthieno[2,3-d]pyrimidin-4-one |
CAS: |
43088-53-5 |
Synonyms: |
3-Amino-2,6-dimethyl-5-phenylthieno[2,3-d]pyrimidin-4(3H)-one; SCHEMBL3754164; ZINC8536161 |
IUPAC Name: | 3-amino-2,6-dimethyl-5-phenylthieno[2,3-d]pyrimidin-4-one |
Description: | 3-Amino-2,6-dimethyl-5-phenylthieno[2,3-d]pyrimidin-4-one (CAS# 43088-53-5 ) is a useful research chemical. |
Molecular Weight: | 271.34 |
Molecular Formula: | C14H13N3OS |
Canonical SMILES: | CC1=C(C2=C(S1)N=C(N(C2=O)N)C)C3=CC=CC=C3 |
InChI: | InChI=1S/C14H13N3OS/c1-8-11(10-6-4-3-5-7-10)12-13(19-8)16-9(2)17(15)14(12)18/h3-7H,15H2,1-2H3 |
InChI Key: | CHABJJROHCVHJN-UHFFFAOYSA-N |
Complexity: | 406 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 271.07793322 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 271.07793322 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 86.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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