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92184-45-7 | 2,4-DIAMINO-QUINAZOLINE-6-SULFONIC ACID (3-BROMO-PHENYL)-AMIDE
CAS No: 92184-45-7 Catalog No: AG006GJY MDL No:
Product Description
Catalog Number:
AG006GJY
Chemical Name:
2,4-DIAMINO-QUINAZOLINE-6-SULFONIC ACID (3-BROMO-PHENYL)-AMIDE
CAS Number:
92184-45-7
Molecular Formula:
C14H12BrN5O2S
Molecular Weight:
394.2464
IUPAC Name:
2,4-diamino-N-(3-bromophenyl)quinazoline-6-sulfonamide
InChI:
InChI=1S/C14H12BrN5O2S/c15-8-2-1-3-9(6-8)20-23(21,22)10-4-5-12-11(7-10)13(16)19-14(17)18-12/h1-7,20H,(H4,16,17,18,19)
InChI Key:
QTSNXDQKDYBOQS-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)NS(=O)(=O)c1ccc2c(c1)c(N)nc(n2)N
Properties
Complexity:
514
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
392.99g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
394.247g/mol
Monoisotopic Mass:
392.99g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
132A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Literature
| Title | Journal |
|---|---|
| Folate antagonists. 22. Antimalarial and antibacterial effects of 2,4-diamino-6-quinazolinesulfonamides. | Journal of medicinal chemistry 19841201 |
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