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1375069-36-5 | Carbamic acid, N-(1,2,3,4-tetrahydro-1,3-dimethyl-2,4-dioxo-5-pyrimidinyl)-, phenylmethyl ester
CAS No: 1375069-36-5 Catalog No: AG0013GE MDL No:MFCD22205824
Product Description
Catalog Number:
AG0013GE
Chemical Name:
Carbamic acid, N-(1,2,3,4-tetrahydro-1,3-dimethyl-2,4-dioxo-5-pyrimidinyl)-, phenylmethyl ester
CAS Number:
1375069-36-5
Molecular Formula:
C14H15N3O4
Molecular Weight:
289.2866
MDL Number:
MFCD22205824
IUPAC Name:
benzyl N-(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)carbamate
InChI:
InChI=1S/C14H15N3O4/c1-16-8-11(12(18)17(2)14(16)20)15-13(19)21-9-10-6-4-3-5-7-10/h3-8H,9H2,1-2H3,(H,15,19)
InChI Key:
YVIIFANSLALIDM-UHFFFAOYSA-N
SMILES:
O=C(Nc1cn(C)c(=O)n(c1=O)C)OCc1ccccc1
Properties
Complexity:
469
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.106g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
289.291g/mol
Monoisotopic Mass:
289.106g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
79A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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