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89423-60-9 | Carbamic acid, thieno[2,3-b]pyridin-6-yl-, ethyl ester
CAS No: 89423-60-9 Catalog No: AG0044SA MDL No:
Product Description
Catalog Number:
AG0044SA
Chemical Name:
Carbamic acid, thieno[2,3-b]pyridin-6-yl-, ethyl ester
CAS Number:
89423-60-9
Molecular Formula:
C10H10N2O2S
Molecular Weight:
222.2636
IUPAC Name:
ethyl N-thieno[2,3-b]pyridin-6-ylcarbamate
InChI:
InChI=1S/C10H10N2O2S/c1-2-14-10(13)12-8-4-3-7-5-6-15-9(7)11-8/h3-6H,2H2,1H3,(H,11,12,13)
InChI Key:
FWUKBQDEWUVWEI-UHFFFAOYSA-N
SMILES:
CCOC(=O)Nc1ccc2c(n1)scc2
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.046g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.262g/mol
Monoisotopic Mass:
222.046g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
79.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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