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Home > Pyridines > 947669-91-2
947669-91-2 | 4'-Carbamoyl-[1,1'-biphenyl]-4-yl methyl(3-(pyridin-4-yl)benzyl)carbamate
CAS No: 947669-91-2 Catalog No: AG003VBX MDL No:MFCD10567112
Product Description
Catalog Number:
AG003VBX
Chemical Name:
4'-Carbamoyl-[1,1'-biphenyl]-4-yl methyl(3-(pyridin-4-yl)benzyl)carbamate
CAS Number:
947669-91-2
Molecular Formula:
C27H23N3O3
Molecular Weight:
437.4898
MDL Number:
MFCD10567112
IUPAC Name:
[4-(4-carbamoylphenyl)phenyl] N-methyl-N-[(3-pyridin-4-ylphenyl)methyl]carbamate
InChI:
InChI=1S/C27H23N3O3/c1-30(18-19-3-2-4-24(17-19)22-13-15-29-16-14-22)27(32)33-25-11-9-21(10-12-25)20-5-7-23(8-6-20)26(28)31/h2-17H,18H2,1H3,(H2,28,31)
InChI Key:
QTWNORFUQILKJL-UHFFFAOYSA-N
SMILES:
O=C(N(Cc1cccc(c1)c1ccncc1)C)Oc1ccc(cc1)c1ccc(cc1)C(=O)N
Properties
Complexity:
635
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
437.174g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
437.499g/mol
Monoisotopic Mass:
437.174g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
85.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
Literature
| Title | Journal |
|---|---|
| WWL70 attenuates PGE(2) production derived from 2-arachidonoylglycerol in microglia by ABHD6-independent mechanism. | Journal of neuroinflammation 20170101 |
| Selective blockade of 2-arachidonoylglycerol hydrolysis produces cannabinoid behavioral effects. | Nature chemical biology 20090101 |
| A functional proteomic strategy to discover inhibitors for uncharacterized hydrolases. | Journal of the American Chemical Society 20070808 |
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