A3956/0168541
TL;DR: A3956/0168541 (CAS 881602-96-6) is a chemical compound with molecular formula C18H18FN3O2 and molecular weight 327.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(1,3-dimethyl-2-oxobenzimidazol-5-yl)methyl]-2-(4-fluorophenyl)acetamide
Also Known As: A3956/0168541, N-[(1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)methyl]-2-(4-fluorophenyl)acetamide, N-[(1,3-dimethyl-2-oxobenzimidazol-5-yl)methyl]-2-(4-fluorophenyl)acetamide, Benzeneacetamide, N-[(2,3-dihydro-1,3-dimethyl-2-oxo-1H-1,3-benzimidazol-5-yl)methyl]-4-fluoro-
| Molecular Formula | C18H18FN3O2 |
|---|---|
| Molecular Weight | 327.14 g/mol |
| LogP | 1.875 |
| Topological Polar Surface Area | 56.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 327.1383 |
| Heavy Atoms | 24 |
| Complexity | 954.7946 |
Chemical Identifiers
| CAS Number | 881602-96-6 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)CNC(=O)CC3=CC=C(C=C3)F)N(C1=O)C |
Product Overview
A3956/0168541 (CAS 881602-96-6), with molecular formula C18H18FN3O2 and molecular weight 327.14 g/mol. IUPAC: N-[(1,3-dimethyl-2-oxobenzimidazol-5-yl)methyl]-2-(4-fluorophenyl)acetamide.
Chemical Property Profile of A3956/0168541
Property Insights of A3956/0168541
The XLogP value of 1.875 suggests moderate lipophilicity, balancing water solubility and membrane permeability for A3956/0168541. With a topological polar surface area (TPSA) of 56.03 Ų, A3956/0168541 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, A3956/0168541 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3956/0168541?
The CAS number of A3956/0168541 is 881602-96-6.
What is the molecular formula of A3956/0168541?
The molecular formula of A3956/0168541 is C18H18FN3O2.
What is the molecular weight of A3956/0168541?
The molecular weight of A3956/0168541 is 327.14 g/mol.
Where can I buy A3956/0168541?
You can request a quote for A3956/0168541 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3956/0168541?
Yes, KEHONG BIO provides custom synthesis services for A3956/0168541 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.