F2729-0050
TL;DR: F2729-0050 (CAS 905763-82-8) is a chemical compound with molecular formula C21H29N3O3S and molecular weight 403.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-(4-methylphenyl)imino-3-(3-morpholin-4-ylpropyl)-1,3-thiazol-4-yl]acetate
Also Known As: F2729-0050, ethyl 2-[(2Z)-2-[(4-methylphenyl)imino]-3-[3-(morpholin-4-yl)propyl]-2,3-dihydro-1,3-thiazol-4-yl]acetate, (Z)-ethyl 2-(3-(3-morpholinopropyl)-2-(p-tolylimino)-2,3-dihydrothiazol-4-yl)acetate, Ethyl 2-[2-(4-methylphenyl)imino-3-(3-morpholin-4-ylpropyl)-1,3-thiazol-4-yl]acetate
| Molecular Formula | C21H29N3O3S |
|---|---|
| Molecular Weight | 403.19 g/mol |
| LogP | 2.91832 |
| Topological Polar Surface Area | 56.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 403.19296 |
| Heavy Atoms | 28 |
| Complexity | 820.1665 |
Chemical Identifiers
| CAS Number | 905763-82-8 |
|---|---|
| SMILES | CCOC(=O)CC1=CSC(=NC2=CC=C(C=C2)C)N1CCCN3CCOCC3 |
Product Overview
F2729-0050 (CAS 905763-82-8), with molecular formula C21H29N3O3S and molecular weight 403.19 g/mol. IUPAC: ethyl 2-[2-(4-methylphenyl)imino-3-(3-morpholin-4-ylpropyl)-1,3-thiazol-4-yl]acetate.
Chemical Property Profile of F2729-0050
Property Insights of F2729-0050
The XLogP value of 2.91832 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F2729-0050. With a topological polar surface area (TPSA) of 56.06 Ų, F2729-0050 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F2729-0050 has 0 hydrogen bond donor(s) and 6 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 F2729-0050?
The CAS number of F2729-0050 is 905763-82-8.
What is the molecular formula of F2729-0050?
The molecular formula of F2729-0050 is C21H29N3O3S.
What is the molecular weight of F2729-0050?
The molecular weight of F2729-0050 is 403.19 g/mol.
Where can I buy F2729-0050?
You can request a quote for F2729-0050 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F2729-0050?
Yes, KEHONG BIO provides custom synthesis services for F2729-0050 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.