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21004-32-0 | Furo[2,3-d]pyrimidine-2,4(1H,3H)-dione, 5,6-dihydro-3-phenyl-
CAS No: 21004-32-0 Catalog No: AG002KJZ MDL No:
Product Description
Catalog Number:
AG002KJZ
Chemical Name:
Furo[2,3-d]pyrimidine-2,4(1H,3H)-dione, 5,6-dihydro-3-phenyl-
CAS Number:
21004-32-0
Molecular Formula:
C12H10N2O3
Molecular Weight:
230.2194
IUPAC Name:
3-phenyl-5,6-dihydro-1H-furo[2,3-d]pyrimidine-2,4-dione
InChI:
InChI=1S/C12H10N2O3/c15-11-9-6-7-17-10(9)13-12(16)14(11)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,13,16)
InChI Key:
NLVMMANVQIFKKM-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2OCCc2c(=O)n1c1ccccc1
NSC Number:
112555
Properties
Complexity:
397
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.069g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
230.223g/mol
Monoisotopic Mass:
230.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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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