8-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenylthiazol-2-yl)cyclohepta[c]pyrrol-4(2H)-one
TL;DR: 8-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenylthiazol-2-yl)cyclohepta[c]pyrrol-4(2H)-one (CAS 434296-80-7) is a chemical compound with molecular formula C23H22N2O2S and molecular weight 390.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenyl-1,3-thiazol-2-yl)cyclohepta[c]pyrrol-8-one
Also Known As: 8-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenylthiazol-2-yl)cyclohepta[c]pyrrol-4(2H)-one, 4-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenyl-1,3-thiazol-2-yl)cyclohepta[c]pyrrol-8-one, 8-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenyl-1,3-thiazol-2-yl)cyclohepta[c]pyrrol-4(2H)-one
| Molecular Formula | C23H22N2O2S |
|---|---|
| Molecular Weight | 390.14 g/mol |
| LogP | 5.43816 |
| Topological Polar Surface Area | 44.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 390.1402 |
| Heavy Atoms | 28 |
| Complexity | 1223.0603 |
Chemical Identifiers
| CAS Number | 434296-80-7 |
|---|---|
| SMILES | CCOC1=CC=CC(=O)C2=C(N(C(=C12)C)C3=NC(=C(S3)C)C4=CC=CC=C4)C |
Product Overview
8-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenylthiazol-2-yl)cyclohepta[c]pyrrol-4(2H)-one (CAS 434296-80-7), with molecular formula C23H22N2O2S and molecular weight 390.14 g/mol. IUPAC: 4-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenyl-1,3-thiazol-2-yl)cyclohepta[c]pyrrol-8-one.
Chemical Property Profile of 8-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenylthiazol-2-yl)cyclohepta[c]pyrrol-4(2H)-one
Property Insights of 8-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenylthiazol-2-yl)cyclohepta[c]pyrrol-4(2H)-one
The XLogP value of 5.43816 indicates that 8-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenylthiazol-2-yl)cyclohepta[c]pyrrol-4(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.12 Ų, 8-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenylthiazol-2-yl)cyclohepta[c]pyrrol-4(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenylthiazol-2-yl)cyclohepta[c]pyrrol-4(2H)-one has 0 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 8-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenylthiazol-2-yl)cyclohepta[c]pyrrol-4(2H)-one?
The CAS number of 8-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenylthiazol-2-yl)cyclohepta[c]pyrrol-4(2H)-one is 434296-80-7.
What is the molecular formula of 8-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenylthiazol-2-yl)cyclohepta[c]pyrrol-4(2H)-one?
The molecular formula of 8-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenylthiazol-2-yl)cyclohepta[c]pyrrol-4(2H)-one is C23H22N2O2S.
What is the molecular weight of 8-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenylthiazol-2-yl)cyclohepta[c]pyrrol-4(2H)-one?
The molecular weight of 8-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenylthiazol-2-yl)cyclohepta[c]pyrrol-4(2H)-one is 390.14 g/mol.
Where can I buy 8-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenylthiazol-2-yl)cyclohepta[c]pyrrol-4(2H)-one?
You can request a quote for 8-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenylthiazol-2-yl)cyclohepta[c]pyrrol-4(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenylthiazol-2-yl)cyclohepta[c]pyrrol-4(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 8-ethoxy-1,3-dimethyl-2-(5-methyl-4-phenylthiazol-2-yl)cyclohepta[c]pyrrol-4(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.