C34H33ClN2O6S
TL;DR: C34H33ClN2O6S (CAS 893701-41-2) is a chemical compound with molecular formula C34H33ClN2O6S and molecular weight 632.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-1-(6-chloro-1,3-benzothiazol-2-yl)-5-(3-ethoxy-4-pentoxyphenyl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
Also Known As: 1-(6-chlorobenzo[d]thiazol-2-yl)-5-(3-ethoxy-4-(pentyloxy)phenyl)-3-hydroxy-4-(2-methyl-2,3-dihydrobenzofuran-5-carbonyl)-1H-pyrrol-2(5H)-one, (4E)-1-(6-chloro-1,3-benzothiazol-2-yl)-5-(3-ethoxy-4-pentoxyphenyl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione, (4E)-1-(6-chloro-1,3-benzothiazol-2-yl)-5-[3-ethoxy-4-(pentyloxy)phenyl]-4-[hydroxy(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione
| Molecular Formula | C34H33ClN2O6S |
|---|---|
| Molecular Weight | 632.17 g/mol |
| LogP | 7.8671 |
| Topological Polar Surface Area | 98.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 632.1748 |
| Heavy Atoms | 44 |
| Complexity | 1782.9115 |
Chemical Identifiers
| CAS Number | 893701-41-2 |
|---|---|
| SMILES | CCCCCOC1=C(C=C(C=C1)C2/C(=C(/C3=CC4=C(C=C3)OC(C4)C)\O)/C(=O)C(=O)N2C5=NC6=C(S5)C=C(C=C6)Cl)OCC |
Product Overview
C34H33ClN2O6S (CAS 893701-41-2), with molecular formula C34H33ClN2O6S and molecular weight 632.17 g/mol. IUPAC: (4E)-1-(6-chloro-1,3-benzothiazol-2-yl)-5-(3-ethoxy-4-pentoxyphenyl)-4-[hydroxy-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)methylidene]pyrrolidine-2,3-dione.
Chemical Property Profile of C34H33ClN2O6S
Property Insights of C34H33ClN2O6S
The XLogP value of 7.8671 indicates that C34H33ClN2O6S is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.19 Ų falls within the moderate polarity range, balancing permeability and solubility for C34H33ClN2O6S. Following Lipinski's Rule of Five, C34H33ClN2O6S has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C34H33ClN2O6S?
The CAS number of C34H33ClN2O6S is 893701-41-2.
What is the molecular formula of C34H33ClN2O6S?
The molecular formula of C34H33ClN2O6S is C34H33ClN2O6S.
What is the molecular weight of C34H33ClN2O6S?
The molecular weight of C34H33ClN2O6S is 632.17 g/mol.
Where can I buy C34H33ClN2O6S?
You can request a quote for C34H33ClN2O6S directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C34H33ClN2O6S?
Yes, KEHONG BIO provides custom synthesis services for C34H33ClN2O6S and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.