4712-49-6 Usage
General Description
4,6-Dimethyl[1,2,5]thiadiazolo[3,4-d]pyrimidine-5,7(4H,6H)-dione, also known as DMTP, is a chemical compound with potential applications in pharmaceutical and agricultural industries. It is a heterocyclic compound containing a thiadiazole ring fused to a pyrimidine ring, and it exists in its dione form. DMTP has been studied for its potential use in the development of new drugs due to its biological activity, including antimicrobial and antitumor properties. Additionally, it has been explored for its potential use as an herbicide in agriculture. Its molecular structure and properties make it an interesting compound for further research and potential development in various fields.
Check Digit Verification of cas no
The CAS Registry Mumber 4712-49-6 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 4,7,1 and 2 respectively; the second part has 2 digits, 4 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 4712-49:
(6*4)+(5*7)+(4*1)+(3*2)+(2*4)+(1*9)=86
86 % 10 = 6
So 4712-49-6 is a valid CAS Registry Number.
InChI:InChI=1/C6H6N4O2S/c1-9-4-3(7-13-8-4)5(11)10(2)6(9)12/h1-2H3
4712-49-6Relevant articles and documents
THE SYNTHESIS AND STRUCTURE OF 4,6-DIOXOPYRIMIDO-2,1,3-THIADIAZOLES
Kravtsov, V. Kh.,Chumakov, Yu. M.,D'yachenko, S. A.,Biyushkin, V. N.,Bureneva, M. I.,Malinovskii, T. I.
, p. 311 - 317 (1990)
Synthesis and spectral indices were reported for four 4,6-dioxopyrimido-2,1,3-thiadiazoles.An x-ray diffraction structural analysis carried out using an automatic diffractometer, λMoKα radiation, 1433 reflections yielded the structure of 4,6-dioxo-5,7-dimethylpyrimido-2,1,3-thiadiazole (R = 4.7percent, Rw = 5.0percent).The molecule, with the exception of the methyl group hydrogen atoms, is planar.Bond delocalization is found within the heterocycles.A CNDO/2 calculation using the spd basis taking account of all the valence electrons showed that the sulfur 3d orbitals playa significant role in the formation of the S-N bonds.Anomalously short intermolecular S...O (3.033 Angstroem) and C...O contacts (2.914 Angstroem) were found in the crystal structure.
