N,N,2-Trimethyl-4-[(phenylmethyl)oxy]-1H-benzimidazole-6-carboxamide - CAS 942195-84-8
Catalog: |
BB057085 |
Product Name: |
N,N,2-Trimethyl-4-[(phenylmethyl)oxy]-1H-benzimidazole-6-carboxamide |
CAS: |
942195-84-8 |
Synonyms: |
N,N,2-trimethyl-7-phenylmethoxy-3H-benzimidazole-5-carboxamide; 1H-Benzimidazole-5-carboxamide, N,N,2-trimethyl-7-(phenylmethoxy)-; 7-(Benzyloxy)-N,N,2-trimethyl-1H-benzo[d]imidazole-5-carboxamide; N,N,2-Trimethyl-4-[(phenylmethyl)oxy]-1H-benzimidazole-6-carboxamide; N,N,2-Trimethyl-7-(phenylmethoxy)-1H-benzimidazole-5-carboxamide |
IUPAC Name: | N,N,2-trimethyl-7-phenylmethoxy-3H-benzimidazole-5-carboxamide |
Description: | N,N,2-Trimethyl-4-[(phenylmethyl)oxy]-1H-benzimidazole-6-carboxamide, |
Molecular Weight: | 309.36 |
Molecular Formula: | C18H19N3O2 |
Canonical SMILES: | CC1=NC2=C(N1)C=C(C=C2OCC3=CC=CC=C3)C(=O)N(C)C |
InChI: | InChI=1S/C18H19N3O2/c1-12-19-15-9-14(18(22)21(2)3)10-16(17(15)20-12)23-11-13-7-5-4-6-8-13/h4-10H,11H2,1-3H3,(H,19,20) |
InChI Key: | LMUKCLBCNXTYHK-UHFFFAOYSA-N |
Complexity: | 409 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 309.147726857 |
Formal Charge: | 0 |
Heavy Atom Count: | 23 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 309.147726857 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 58.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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