Home Halogens Benzoicacid, 3-[[[4-(2-chlorophenoxy)-1-piperidinyl]carbonyl]amino]-

Benzoicacid, 3-[[[4-(2-chlorophenoxy)-1-piperidinyl]carbonyl]amino]-

CAS No.:
1058702-87-6
Catalog Number:
AG0084YW
Molecular Formula:
C19H19ClN2O4
Molecular Weight:
374.8182
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Product Description
Catalog Number:
AG0084YW
Chemical Name:
Benzoicacid, 3-[[[4-(2-chlorophenoxy)-1-piperidinyl]carbonyl]amino]-
CAS Number:
1058702-87-6
Molecular Formula:
C19H19ClN2O4
Molecular Weight:
374.8182
MDL Number:
MFCD18642927
IUPAC Name:
3-[[4-(2-chlorophenoxy)piperidine-1-carbonyl]amino]benzoic acid
InChI:
InChI=1S/C19H19ClN2O4/c20-16-6-1-2-7-17(16)26-15-8-10-22(11-9-15)19(25)21-14-5-3-4-13(12-14)18(23)24/h1-7,12,15H,8-11H2,(H,21,25)(H,23,24)
InChI Key:
KTLSGYCNUNMYAW-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(CC1)Oc1ccccc1Cl)Nc1cccc(c1)C(=O)O
Properties
Complexity:
496  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
374.103g/mol
Formal Charge:
0
Heavy Atom Count:
26  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
374.821g/mol
Monoisotopic Mass:
374.103g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5  
Properties