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Home > Thiazole > 1105190-84-8
1105190-84-8 | (6,7-DIMETHYL-5-OXO-2,3-DIHYDRO-5H-[1,3]THIAZOLO[3,2-A]PYRIMIDIN-3-YL)ACE+
CAS No: 1105190-84-8 Catalog No: AG01ARMB MDL No:MFCD11986422
Product Description
Catalog Number:
AG01ARMB
Chemical Name:
(6,7-DIMETHYL-5-OXO-2,3-DIHYDRO-5H-[1,3]THIAZOLO[3,2-A]PYRIMIDIN-3-YL)ACE+
CAS Number:
1105190-84-8
Molecular Formula:
C10H12N2O3S
Molecular Weight:
240.2789
MDL Number:
MFCD11986422
IUPAC Name:
2-(6,7-dimethyl-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-3-yl)acetic acid
InChI:
InChI=1S/C10H12N2O3S/c1-5-6(2)11-10-12(9(5)15)7(4-16-10)3-8(13)14/h7H,3-4H2,1-2H3,(H,13,14)
InChI Key:
VETNCOCDGBDTEC-UHFFFAOYSA-N
SMILES:
Cc1c(C)nc2n(c1=O)C(CC(=O)O)CS2
Properties
Complexity:
428
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.057g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
240.277g/mol
Monoisotopic Mass:
240.057g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
95.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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