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30076-55-2

30076-55-2 | 6-Benzothiazolecarbamicacid, 2-piperidino-, ethyl ester (8CI)

CAS No: 30076-55-2 Catalog No: AG007JL8 MDL No:

Product Description

Catalog Number:
AG007JL8
Chemical Name:
6-Benzothiazolecarbamicacid, 2-piperidino-, ethyl ester (8CI)
CAS Number:
30076-55-2
Molecular Formula:
C15H19N3O2S
Molecular Weight:
305.3953
IUPAC Name:
ethyl N-(2-piperidin-1-yl-1,3-benzothiazol-6-yl)carbamate
InChI:
InChI=1S/C15H19N3O2S/c1-2-20-15(19)16-11-6-7-12-13(10-11)21-14(17-12)18-8-4-3-5-9-18/h6-7,10H,2-5,8-9H2,1H3,(H,16,19)
InChI Key:
WAXXZUMFWXSUSF-UHFFFAOYSA-N
SMILES:
CCOC(=O)Nc1ccc2c(c1)sc(n2)N1CCCCC1
NSC Number:
278793

Properties

Complexity:
363  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.12g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
305.396g/mol
Monoisotopic Mass:
305.12g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
82.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  

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