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34790-80-2 | 2(1H)-PYRIMIDINONE, TETRAHYDRO-1-(PHENYLMETHYL)-
CAS No: 34790-80-2 Catalog No: AG003EP8 MDL No:MFCD11870028
Product Description
Catalog Number:
AG003EP8
Chemical Name:
2(1H)-PYRIMIDINONE, TETRAHYDRO-1-(PHENYLMETHYL)-
CAS Number:
34790-80-2
Molecular Formula:
C11H14N2O
Molecular Weight:
190.2417
MDL Number:
MFCD11870028
IUPAC Name:
1-benzyl-1,3-diazinan-2-one
InChI:
InChI=1S/C11H14N2O/c14-11-12-7-4-8-13(11)9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2,(H,12,14)
InChI Key:
WKSFKEGGQALVAF-UHFFFAOYSA-N
SMILES:
O=C1NCCCN1Cc1ccccc1
Properties
Complexity:
200
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.111g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.246g/mol
Monoisotopic Mass:
190.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| Inhibitory effect of novel tetrahydropyrimidine-2(1H)-thiones on melanogenesis. | Bioorganic & medicinal chemistry 20100201 |
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