RefChem:268531
TL;DR: RefChem:268531 (CAS 79759-83-4) is a chemical compound with molecular formula C16H16ClN3O and molecular weight 301.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-3-[4-(dimethylamino)phenyl]-1-methylbenzimidazol-2-one
Also Known As: 1,3-Dihydro-5-chloro-3-(4-(dimethylamino)phenyl)-1-methyl-2H-benzimidazol-2-one, 2H-Benzimidazol-2-one, 1,3-dihydro-5-chloro-3-(4-(dimethylamino)phenyl)-1-methyl-, 5-chloro-3-(4-dimethylaminophenyl)-1-methylbenzimidazol-2-one, 5-Chloro-3-[4-(dimethylamino)phenyl]-1-methyl-1,3-dihydro-2H-1,3-benzimidazol-2-one, 5-Chloro-3-[4-(dimethylamino)phenyl]-1-methyl-1,3-dihydro-2H-benzimidazol-2-one
| Molecular Formula | C16H16ClN3O |
|---|---|
| Molecular Weight | 301.10 g/mol |
| LogP | 3.0486 |
| Topological Polar Surface Area | 30.17 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 301.09818 |
| Heavy Atoms | 21 |
| Complexity | 859.59973 |
Chemical Identifiers
| CAS Number | 79759-83-4 |
|---|---|
| SMILES | CN1C2=C(C=C(C=C2)Cl)N(C1=O)C3=CC=C(C=C3)N(C)C |
Product Overview
RefChem:268531 (CAS 79759-83-4), with molecular formula C16H16ClN3O and molecular weight 301.10 g/mol. IUPAC: 5-chloro-3-[4-(dimethylamino)phenyl]-1-methylbenzimidazol-2-one.
Chemical Property Profile of RefChem:268531
Property Insights of RefChem:268531
The XLogP value of 3.0486 indicates that RefChem:268531 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.17 Ų, RefChem:268531 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:268531 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 RefChem:268531?
The CAS number of RefChem:268531 is 79759-83-4.
What is the molecular formula of RefChem:268531?
The molecular formula of RefChem:268531 is C16H16ClN3O.
What is the molecular weight of RefChem:268531?
The molecular weight of RefChem:268531 is 301.10 g/mol.
Where can I buy RefChem:268531?
You can request a quote for RefChem:268531 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:268531?
Yes, KEHONG BIO provides custom synthesis services for RefChem:268531 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.