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69852-98-8

69852-98-8 | Carbamic acid, [2-(pentyloxy)phenyl]-, 2-(1-piperidinyl)ethyl ester

CAS No: 69852-98-8 Catalog No: AG005HBE MDL No:

Product Description

Catalog Number:
AG005HBE
Chemical Name:
Carbamic acid, [2-(pentyloxy)phenyl]-, 2-(1-piperidinyl)ethyl ester
CAS Number:
69852-98-8
Molecular Formula:
C19H30N2O3
Molecular Weight:
334.4531
IUPAC Name:
2-piperidin-1-ylethyl N-(2-pentoxyphenyl)carbamate
InChI:
InChI=1S/C19H30N2O3/c1-2-3-9-15-23-18-11-6-5-10-17(18)20-19(22)24-16-14-21-12-7-4-8-13-21/h5-6,10-11H,2-4,7-9,12-16H2,1H3,(H,20,22)
InChI Key:
HLXAOPNSWKHGQO-UHFFFAOYSA-N
SMILES:
CCCCCOc1ccccc1NC(=O)OCCN1CCCCC1

Properties

Complexity:
346  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.226g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
334.46g/mol
Monoisotopic Mass:
334.226g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
50.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  

Literature

Title Journal
A new group of potential antituberculotics: hydrochlorides of piperidinylalkyl esters of alkoxy-substituted phenylcarbamic acids. Folia microbiologica 20040101
Antimycobacterial activity of basic ethyl esters of alkoxy-substituted phenylcarbamic acids. Folia microbiologica 20030101

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