MixCom6_002599
TL;DR: MixCom6_002599 (CAS 300390-54-9) is a chemical compound with molecular formula C29H26N2O4S and molecular weight 498.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-2-[[3-ethoxy-4-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one
Also Known As: MixCom6_002599, BIM-0047422.P001, (2Z)-2-(3-ethoxy-4-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}benzylidene)[1,3]thiazolo[3,2-a]benzimidazol-3(2H)-one, (2Z)-2-[[3-ethoxy-4-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one, (Z)-2-(4-(2-(2-allylphenoxy)ethoxy)-3-ethoxybenzylidene)benzo[4,5]imidazo[2,1-b]thiazol-3(2H)-one
| Molecular Formula | C29H26N2O4S |
|---|---|
| Molecular Weight | 498.16 g/mol |
| LogP | 5.0419 |
| Topological Polar Surface Area | 62.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 498.16132 |
| Heavy Atoms | 36 |
| Complexity | 1636.6705 |
Chemical Identifiers
| CAS Number | 300390-54-9 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)/C=C\2/C(=O)N3C4=CC=CC=C4N=C3S2)OCCOC5=CC=CC=C5CC=C |
Product Overview
MixCom6_002599 (CAS 300390-54-9), with molecular formula C29H26N2O4S and molecular weight 498.16 g/mol. IUPAC: (2Z)-2-[[3-ethoxy-4-[2-(2-prop-2-enylphenoxy)ethoxy]phenyl]methylidene]-[1,3]thiazolo[3,2-a]benzimidazol-1-one.
Chemical Property Profile of MixCom6_002599
Property Insights of MixCom6_002599
The XLogP value of 5.0419 indicates that MixCom6_002599 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.06 Ų falls within the moderate polarity range, balancing permeability and solubility for MixCom6_002599. Following Lipinski's Rule of Five, MixCom6_002599 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of MixCom6_002599?
The CAS number of MixCom6_002599 is 300390-54-9.
What is the molecular formula of MixCom6_002599?
The molecular formula of MixCom6_002599 is C29H26N2O4S.
What is the molecular weight of MixCom6_002599?
The molecular weight of MixCom6_002599 is 498.16 g/mol.
Where can I buy MixCom6_002599?
You can request a quote for MixCom6_002599 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for MixCom6_002599?
Yes, KEHONG BIO provides custom synthesis services for MixCom6_002599 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.