ChemDiv1_024455
TL;DR: ChemDiv1_024455 (CAS 374544-82-8) is a chemical compound with molecular formula C25H21N3 and molecular weight 363.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-benzyl-5-methyl-8-phenyl-2,6-diazatricyclo[7.3.0.03,7]dodeca-1(9),2,4,7-tetraene-4-carbonitrile
Also Known As: ChemDiv1_024455, 1-benzyl-2-methyl-8-phenyl-1,5,6,7-tetrahydrocyclopenta[b]pyrrolo[2,3-e]pyridine-3-carbonitrile
| Molecular Formula | C25H21N3 |
|---|---|
| Molecular Weight | 363.17 g/mol |
| LogP | 5.4204 |
| Topological Polar Surface Area | 41.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 363.17355 |
| Heavy Atoms | 28 |
| Complexity | 1212.1157 |
Chemical Identifiers
| CAS Number | 374544-82-8 |
|---|---|
| SMILES | CC1=C(C2=NC3=C(CCC3)C(=C2N1CC4=CC=CC=C4)C5=CC=CC=C5)C#N |
Product Overview
ChemDiv1_024455 (CAS 374544-82-8), with molecular formula C25H21N3 and molecular weight 363.17 g/mol. IUPAC: 6-benzyl-5-methyl-8-phenyl-2,6-diazatricyclo[7.3.0.03,7]dodeca-1(9),2,4,7-tetraene-4-carbonitrile.
Chemical Property Profile of ChemDiv1_024455
Property Insights of ChemDiv1_024455
The XLogP value of 5.4204 indicates that ChemDiv1_024455 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.61 Ų, ChemDiv1_024455 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_024455 has 0 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 ChemDiv1_024455?
The CAS number of ChemDiv1_024455 is 374544-82-8.
What is the molecular formula of ChemDiv1_024455?
The molecular formula of ChemDiv1_024455 is C25H21N3.
What is the molecular weight of ChemDiv1_024455?
The molecular weight of ChemDiv1_024455 is 363.17 g/mol.
Where can I buy ChemDiv1_024455?
You can request a quote for ChemDiv1_024455 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_024455?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_024455 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.