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10493-24-0

10493-24-0 | Carbamic acid,N-(6-methoxy-1H-benzimidazol-2-yl)-, methyl ester

CAS No: 10493-24-0 Catalog No: AG0085IS MDL No:

Product Description

Catalog Number:
AG0085IS
Chemical Name:
Carbamic acid,N-(6-methoxy-1H-benzimidazol-2-yl)-, methyl ester
CAS Number:
10493-24-0
Molecular Formula:
C10H10N3O3-
Molecular Weight:
220.2047
IUPAC Name:
methyl N-(6-methoxy-1H-benzimidazol-2-yl)carbamate
InChI:
InChI=1S/C10H11N3O3/c1-15-6-3-4-7-8(5-6)12-9(11-7)13-10(14)16-2/h3-5H,1-2H3,(H2,11,12,13,14)
InChI Key:
FMXXOLSFGZXVMC-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)[nH]c(n2)N(C(=O)[O-])C

Properties

Complexity:
262  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.08g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
221.216g/mol
Monoisotopic Mass:
221.08g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

Literature

Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101

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