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606106-13-2 | Acetamide, 2-[(1,4,5,6,7,8-hexahydro-4-oxo[1]benzothieno[2,3-d]pyrimidin-2-yl)thio]-N-(5-methyl-3-isoxazolyl)- (9CI)
CAS No: 606106-13-2 Catalog No: AG00EMBU MDL No:
Product Description
Catalog Number:
AG00EMBU
Chemical Name:
Acetamide, 2-[(1,4,5,6,7,8-hexahydro-4-oxo[1]benzothieno[2,3-d]pyrimidin-2-yl)thio]-N-(5-methyl-3-isoxazolyl)- (9CI)
CAS Number:
606106-13-2
IUPAC Name:
N-(5-methyl-1,2-oxazol-3-yl)-2-[(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide
InChI:
InChI=1S/C16H16N4O3S2/c1-8-6-11(20-23-8)17-12(21)7-24-16-18-14(22)13-9-4-2-3-5-10(9)25-15(13)19-16/h6H,2-5,7H2,1H3,(H,17,20,21)(H,18,19,22)
InChI Key:
FBZNDWZZQFNHKW-UHFFFAOYSA-N
Properties
Complexity:
588
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
376.066g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
376.449g/mol
Monoisotopic Mass:
376.066g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
150A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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