KC 2846
TL;DR: KC 2846 (CAS 124783-68-2) is a chemical compound with molecular formula C18H15BrFN3O and molecular weight 387.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2E)-2-[7-bromo-5-(2-fluorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-ylidene]acetamide
Also Known As: KC 2846, (2E)-2-[7-bromo-5-(2-fluorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-ylidene]acetamide, Acetamide, 2-(7-bromo-5-(2-fluorophenyl)-1,3-dihydro-1-methyl-2H-1,4-benzodiazepin-2-ylidene)-, (E)-, 2-[7-bromo-5-(2-fluorophenyl)-1-methyl-2,3-dihydro-1H-1,4-benzodiazepin-2-ylidene]acetamide, 7-Bromo-1-methyl-2-[(carbamoyl)methylene]-5-(2-fluorophenyl)-1,3-dihydro-2H-1,4-benzodiazepine
| Molecular Formula | C18H15BrFN3O |
|---|---|
| Molecular Weight | 387.04 g/mol |
| LogP | 3.2446 |
| Topological Polar Surface Area | 58.69 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 387.03824 |
| Heavy Atoms | 24 |
| Complexity | 876.3176 |
Chemical Identifiers
| CAS Number | 124783-68-2 |
|---|---|
| SMILES | CN1/C(=C/C(=O)N)/CN=C(C2=C1C=CC(=C2)Br)C3=CC=CC=C3F |
Product Overview
KC 2846 (CAS 124783-68-2), with molecular formula C18H15BrFN3O and molecular weight 387.04 g/mol. IUPAC: (2E)-2-[7-bromo-5-(2-fluorophenyl)-1-methyl-3H-1,4-benzodiazepin-2-ylidene]acetamide.
Chemical Property Profile of KC 2846
Property Insights of KC 2846
The XLogP value of 3.2446 indicates that KC 2846 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.69 Ų, KC 2846 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, KC 2846 has 1 hydrogen bond donor(s) and 3 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 KC 2846?
The CAS number of KC 2846 is 124783-68-2.
What is the molecular formula of KC 2846?
The molecular formula of KC 2846 is C18H15BrFN3O.
What is the molecular weight of KC 2846?
The molecular weight of KC 2846 is 387.04 g/mol.
Where can I buy KC 2846?
You can request a quote for KC 2846 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KC 2846?
Yes, KEHONG BIO provides custom synthesis services for KC 2846 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.