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29558-43-8 | 5H-Thiazolo[3,2-a]pyrimidin-5-one, 2,3-dihydro-6-phenyl-
CAS No: 29558-43-8 Catalog No: AG002YRC MDL No:
Product Description
Catalog Number:
AG002YRC
Chemical Name:
5H-Thiazolo[3,2-a]pyrimidin-5-one, 2,3-dihydro-6-phenyl-
CAS Number:
29558-43-8
Molecular Formula:
C12H10N2OS
Molecular Weight:
230.2856
IUPAC Name:
6-phenyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one
InChI:
InChI=1S/C12H10N2OS/c15-11-10(9-4-2-1-3-5-9)8-13-12-14(11)6-7-16-12/h1-5,8H,6-7H2
InChI Key:
GQWKEFQXORMYTP-UHFFFAOYSA-N
SMILES:
O=c1c(cnc2n1CCS2)c1ccccc1
Properties
Complexity:
369
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.051g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
230.285g/mol
Monoisotopic Mass:
230.051g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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