CDS1_001801
TL;DR: CDS1_001801 (CAS 328038-00-2) is a chemical compound with molecular formula C25H21N3O3S and molecular weight 443.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[2,5-dimethyl-3-[(Z)-(1-oxo-[1,3]thiazolo[3,2-a]benzimidazol-2-ylidene)methyl]pyrrol-1-yl]benzoate
Also Known As: CDS1_001801, (Z)-ethyl 4-(2,5-dimethyl-3-((3-oxobenzo[4,5]imidazo[2,1-b]thiazol-2(3H)-ylidene)methyl)-1H-pyrrol-1-yl)benzoate, ethyl 4-[2,5-dimethyl-3-[(Z)-(1-oxo-[1,3]thiazolo[3,2-a]benzimidazol-2-ylidene)methyl]pyrrol-1-yl]benzoate, ETHYL 4-(2,5-DIMETHYL-3-{[3-OXO[1,3]THIAZOLO[3,2-A][1,3]BENZIMIDAZOL-2(3H)-YLIDEN]METHYL}-1H-PYRROL-1-YL)BENZOATE, ethyl 4-{2,5-dimethyl-3-[(3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]-1H-pyrrol-1-yl}benzoate
| Molecular Formula | C25H21N3O3S |
|---|---|
| Molecular Weight | 443.13 g/mol |
| LogP | 4.04114 |
| Topological Polar Surface Area | 65.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 443.13037 |
| Heavy Atoms | 32 |
| Complexity | 1589.7141 |
Chemical Identifiers
| CAS Number | 328038-00-2 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N2C(=CC(=C2C)/C=C\3/C(=O)N4C5=CC=CC=C5N=C4S3)C |
Product Overview
CDS1_001801 (CAS 328038-00-2), with molecular formula C25H21N3O3S and molecular weight 443.13 g/mol. IUPAC: ethyl 4-[2,5-dimethyl-3-[(Z)-(1-oxo-[1,3]thiazolo[3,2-a]benzimidazol-2-ylidene)methyl]pyrrol-1-yl]benzoate.
Chemical Property Profile of CDS1_001801
Property Insights of CDS1_001801
The XLogP value of 4.04114 indicates that CDS1_001801 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.6 Ų falls within the moderate polarity range, balancing permeability and solubility for CDS1_001801. Following Lipinski's Rule of Five, CDS1_001801 has 0 hydrogen bond donor(s) and 5 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 CDS1_001801?
The CAS number of CDS1_001801 is 328038-00-2.
What is the molecular formula of CDS1_001801?
The molecular formula of CDS1_001801 is C25H21N3O3S.
What is the molecular weight of CDS1_001801?
The molecular weight of CDS1_001801 is 443.13 g/mol.
Where can I buy CDS1_001801?
You can request a quote for CDS1_001801 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CDS1_001801?
Yes, KEHONG BIO provides custom synthesis services for CDS1_001801 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.