MixCom6_002418
TL;DR: MixCom6_002418 (CAS 297159-58-1) is a chemical compound with molecular formula C28H28N2O2 and molecular weight 424.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2,5-dimethylphenyl)-9-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one
Also Known As: MixCom6_002418, BAS 02841736, BIM-0047606.P001, J2.677.144G, A2358/0099588
| Molecular Formula | C28H28N2O2 |
|---|---|
| Molecular Weight | 424.22 g/mol |
| LogP | 6.29154 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 424.2151 |
| Heavy Atoms | 32 |
| Complexity | 1210.3569 |
Chemical Identifiers
| CAS Number | 297159-58-1 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)OC)NC5=CC=CC=C5N2 |
Product Overview
MixCom6_002418 (CAS 297159-58-1), with molecular formula C28H28N2O2 and molecular weight 424.22 g/mol. IUPAC: 6-(2,5-dimethylphenyl)-9-(4-methoxyphenyl)-5,6,8,9,10,11-hexahydrobenzo[b][1,4]benzodiazepin-7-one.
Chemical Property Profile of MixCom6_002418
Property Insights of MixCom6_002418
The XLogP value of 6.29154 indicates that MixCom6_002418 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, MixCom6_002418 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, MixCom6_002418 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of MixCom6_002418?
The CAS number of MixCom6_002418 is 297159-58-1.
What is the molecular formula of MixCom6_002418?
The molecular formula of MixCom6_002418 is C28H28N2O2.
What is the molecular weight of MixCom6_002418?
The molecular weight of MixCom6_002418 is 424.22 g/mol.
Where can I buy MixCom6_002418?
You can request a quote for MixCom6_002418 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for MixCom6_002418?
Yes, KEHONG BIO provides custom synthesis services for MixCom6_002418 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.