Home Carboxys 3-(1-{[(9H-fluoren-9-yl)methoxy]carbonyl}piperidin-4-yl)-1,2-oxazole-5-carboxylic acid

3-(1-{[(9H-fluoren-9-yl)methoxy]carbonyl}piperidin-4-yl)-1,2-oxazole-5-carboxylic acid

CAS No.:
2137762-40-2
Catalog Number:
AG01EKVI
Molecular Formula:
C24H22N2O5
Molecular Weight:
418.4419
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Product Description
Catalog Number:
AG01EKVI
Chemical Name:
3-(1-{[(9H-fluoren-9-yl)methoxy]carbonyl}piperidin-4-yl)-1,2-oxazole-5-carboxylic acid
CAS Number:
2137762-40-2
Molecular Formula:
C24H22N2O5
Molecular Weight:
418.4419
MDL Number:
MFCD31421845
IUPAC Name:
3-[1-(9H-fluoren-9-ylmethoxycarbonyl)piperidin-4-yl]-1,2-oxazole-5-carboxylic acid
InChI:
InChI=1S/C24H22N2O5/c27-23(28)22-13-21(25-31-22)15-9-11-26(12-10-15)24(29)30-14-20-18-7-3-1-5-16(18)17-6-2-4-8-19(17)20/h1-8,13,15,20H,9-12,14H2,(H,27,28)
InChI Key:
WNFBSDXZSCNISZ-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(CC1)c1noc(c1)C(=O)O)OCC1c2ccccc2c2c1cccc2
Properties
Complexity:
642  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
418.153g/mol
Formal Charge:
0
Heavy Atom Count:
31  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
418.449g/mol
Monoisotopic Mass:
418.153g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
92.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Properties