200,000+ products from a single source!
sales@angenechem.com
Home > Imidazoles > 3097-21-0
3097-21-0 | 2H-Benzimidazol-2-one, 1,3-dihydro-1,3-dimethyl-
CAS No: 3097-21-0 Catalog No: AG0031RU MDL No:MFCD00224248
Product Description
Catalog Number:
AG0031RU
Chemical Name:
2H-Benzimidazol-2-one, 1,3-dihydro-1,3-dimethyl-
CAS Number:
3097-21-0
Molecular Formula:
C9H10N2O
Molecular Weight:
162.1885
MDL Number:
MFCD00224248
IUPAC Name:
1,3-dimethylbenzimidazol-2-one
InChI:
InChI=1S/C9H10N2O/c1-10-7-5-3-4-6-8(7)11(2)9(10)12/h3-6H,1-2H3
InChI Key:
NOJXCBIUEXCLMZ-UHFFFAOYSA-N
SMILES:
O=c1n(C)c2c(n1C)cccc2
NSC Number:
27983
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.079g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.192g/mol
Monoisotopic Mass:
162.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.6A^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 |
| Toward prediction of alkane/water partition coefficients. | Journal of medicinal chemistry 20080710 |
| Theoretical and experimental design of atypical kinase inhibitors: application to p38 MAP kinase. | Journal of medicinal chemistry 20050908 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.