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440111-63-7 | Thiazolo[4,5-d]pyrimidin-7(6H)-one, 3-ethyl-2,3-dihydro-6-methyl-2-thioxo- (9CI)
CAS No: 440111-63-7 Catalog No: AG00DHKZ MDL No:
Product Description
Catalog Number:
AG00DHKZ
Chemical Name:
Thiazolo[4,5-d]pyrimidin-7(6H)-one, 3-ethyl-2,3-dihydro-6-methyl-2-thioxo- (9CI)
CAS Number:
440111-63-7
IUPAC Name:
3-ethyl-6-methyl-2-sulfanylidene-[1,3]thiazolo[4,5-d]pyrimidin-7-one
InChI:
InChI=1S/C8H9N3OS2/c1-3-11-6-5(14-8(11)13)7(12)10(2)4-9-6/h4H,3H2,1-2H3
InChI Key:
DXNXBAYYHWPHEJ-UHFFFAOYSA-N
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.019g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
227.3g/mol
Monoisotopic Mass:
227.019g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
93.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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