3K-308S
TL;DR: 3K-308S (CAS 338412-02-5) is a chemical compound with molecular formula C23H21Cl2N3O and molecular weight 425.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[1-[(4-tert-butylphenyl)methyl]-5,6-dichlorobenzimidazol-2-yl]-1H-pyridin-2-one
Also Known As: 3K-308S, 3-{1-[4-(tert-butyl)benzyl]-5,6-dichloro-1H-1,3-benzimidazol-2-yl}-2(1H)-pyridinone, 3-{1-[(4-tert-butylphenyl)methyl]-5,6-dichloro-1H-1,3-benzodiazol-2-yl}-1,2-dihydropyridin-2-one, 3-[1-[(4-tert-butylphenyl)methyl]-5,6-dichlorobenzimidazol-2-yl]-1H-pyridin-2-one, 3-[3-[(4-tert-butylphenyl)methyl]-5,6-dichloro-1H-benzimidazol-2-ylidene]pyridin-2-one
| Molecular Formula | C23H21Cl2N3O |
|---|---|
| Molecular Weight | 425.11 g/mol |
| LogP | 6.0442 |
| Topological Polar Surface Area | 50.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 425.10617 |
| Heavy Atoms | 29 |
| Complexity | 1248.085 |
Chemical Identifiers
| CAS Number | 338412-02-5 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)CN2C3=CC(=C(C=C3N=C2C4=CC=CNC4=O)Cl)Cl |
Product Overview
3K-308S (CAS 338412-02-5), with molecular formula C23H21Cl2N3O and molecular weight 425.11 g/mol. IUPAC: 3-[1-[(4-tert-butylphenyl)methyl]-5,6-dichlorobenzimidazol-2-yl]-1H-pyridin-2-one.
Chemical Property Profile of 3K-308S
Property Insights of 3K-308S
The XLogP value of 6.0442 indicates that 3K-308S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.68 Ų, 3K-308S exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3K-308S has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3K-308S?
The CAS number of 3K-308S is 338412-02-5.
What is the molecular formula of 3K-308S?
The molecular formula of 3K-308S is C23H21Cl2N3O.
What is the molecular weight of 3K-308S?
The molecular weight of 3K-308S is 425.11 g/mol.
Where can I buy 3K-308S?
You can request a quote for 3K-308S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3K-308S?
Yes, KEHONG BIO provides custom synthesis services for 3K-308S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.