5-Benzoyl-1,3-dimethyl-2(3H)-benzimidazolone
TL;DR: 5-Benzoyl-1,3-dimethyl-2(3H)-benzimidazolone (CAS 313666-16-9) is a chemical compound with molecular formula C16H14N2O2 and molecular weight 266.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-benzoyl-1,3-dimethylbenzimidazol-2-one
Also Known As: 5-benzoyl-1,3-dimethylbenzimidazol-2-one, 5-Benzoyl-1,3-dimethyl-2(3H)-benzimidazolone, 5-benzoyl-1,3-dimethyl-1H-benzo[d]imidazol-2(3H)-one, 5-Benzoyl-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one, 5-Benzoyl-1,3-dimethyl-1,3-dihydro-2H-benzimidazol-2-one #
| Molecular Formula | C16H14N2O2 |
|---|---|
| Molecular Weight | 266.11 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.10553 |
| Heavy Atoms | 20 |
| Complexity | 403.0 |
Chemical Identifiers
| CAS Number | 313666-16-9 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)C(=O)C3=CC=CC=C3)N(C1=O)C |
| InChIKey | LFYCNQSFDUQWME-UHFFFAOYSA-N |
Product Overview
5-Benzoyl-1,3-dimethyl-2(3H)-benzimidazolone (CAS 313666-16-9), with molecular formula C16H14N2O2 and molecular weight 266.11 g/mol. IUPAC: 5-benzoyl-1,3-dimethylbenzimidazol-2-one.
Chemical Property Profile of 5-Benzoyl-1,3-dimethyl-2(3H)-benzimidazolone
Property Insights of 5-Benzoyl-1,3-dimethyl-2(3H)-benzimidazolone
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Benzoyl-1,3-dimethyl-2(3H)-benzimidazolone. With a topological polar surface area (TPSA) of 40.6 Ų, 5-Benzoyl-1,3-dimethyl-2(3H)-benzimidazolone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Benzoyl-1,3-dimethyl-2(3H)-benzimidazolone has 0 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 5-Benzoyl-1,3-dimethyl-2(3H)-benzimidazolone?
The CAS number of 5-Benzoyl-1,3-dimethyl-2(3H)-benzimidazolone is 313666-16-9.
What is the molecular formula of 5-Benzoyl-1,3-dimethyl-2(3H)-benzimidazolone?
The molecular formula of 5-Benzoyl-1,3-dimethyl-2(3H)-benzimidazolone is C16H14N2O2.
What is the molecular weight of 5-Benzoyl-1,3-dimethyl-2(3H)-benzimidazolone?
The molecular weight of 5-Benzoyl-1,3-dimethyl-2(3H)-benzimidazolone is 266.11 g/mol.
Where can I buy 5-Benzoyl-1,3-dimethyl-2(3H)-benzimidazolone?
You can request a quote for 5-Benzoyl-1,3-dimethyl-2(3H)-benzimidazolone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Benzoyl-1,3-dimethyl-2(3H)-benzimidazolone?
Yes, KEHONG BIO provides custom synthesis services for 5-Benzoyl-1,3-dimethyl-2(3H)-benzimidazolone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.