ChemDiv1_018808
TL;DR: ChemDiv1_018808 (CAS 439121-59-2) is a chemical compound with molecular formula C24H21ClN2O2 and molecular weight 404.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(4-chlorophenyl)-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone
Also Known As: ChemDiv1_018808, DivK1c_003592, CDS1_002552, 1-[4-(4-chlorophenyl)-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone, 1-[4-(4-chlorophenyl)-2-(4-methoxyphenyl)-2,3-dihydro-1H-1,5-benzodiazepin-1-yl]ethanone
| Molecular Formula | C24H21ClN2O2 |
|---|---|
| Molecular Weight | 404.13 g/mol |
| LogP | 5.9673 |
| Topological Polar Surface Area | 41.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 404.12915 |
| Heavy Atoms | 29 |
| Complexity | 1058.9985 |
Chemical Identifiers
| CAS Number | 439121-59-2 |
|---|---|
| SMILES | CC(=O)N1C(CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)OC |
Product Overview
ChemDiv1_018808 (CAS 439121-59-2), with molecular formula C24H21ClN2O2 and molecular weight 404.13 g/mol. IUPAC: 1-[4-(4-chlorophenyl)-2-(4-methoxyphenyl)-2,3-dihydro-1,5-benzodiazepin-1-yl]ethanone.
Chemical Property Profile of ChemDiv1_018808
Property Insights of ChemDiv1_018808
The XLogP value of 5.9673 indicates that ChemDiv1_018808 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.9 Ų, ChemDiv1_018808 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_018808 has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_018808?
The CAS number of ChemDiv1_018808 is 439121-59-2.
What is the molecular formula of ChemDiv1_018808?
The molecular formula of ChemDiv1_018808 is C24H21ClN2O2.
What is the molecular weight of ChemDiv1_018808?
The molecular weight of ChemDiv1_018808 is 404.13 g/mol.
Where can I buy ChemDiv1_018808?
You can request a quote for ChemDiv1_018808 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_018808?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_018808 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.