UC57
TL;DR: UC57 (CAS 172998-58-2) is a chemical compound with molecular formula C16H15ClN2O2S and molecular weight 334.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-chloro-3-[(E)-prop-2-enoxyiminomethyl]phenyl]-2-methylfuran-3-carbothioamide
Also Known As: UC57, UC 57, 3-Furancarbothioamide, N-(4-chloro-3-(((2-propenyloxy)imino)methyl)phenyl)-2-methyl-, 2-Methyl-furan-3-carbothioic acid, (3-(allyloxyimino-methyl)-4-chloro-phenyl)-amide, 2-Methyl-furan-3-carbothioic acid, [3-(allyloxyimino-methyl)-4-chloro-phenyl]-amide
| Molecular Formula | C16H15ClN2O2S |
|---|---|
| Molecular Weight | 334.05 g/mol |
| LogP | 4.56552 |
| Topological Polar Surface Area | 46.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 334.0543 |
| Heavy Atoms | 22 |
| Complexity | 709.9214 |
Chemical Identifiers
| CAS Number | 172998-58-2 |
|---|---|
| SMILES | CC1=C(C=CO1)C(=S)NC2=CC(=C(C=C2)Cl)/C=N/OCC=C |
Product Overview
UC57 (CAS 172998-58-2), with molecular formula C16H15ClN2O2S and molecular weight 334.05 g/mol. IUPAC: N-[4-chloro-3-[(E)-prop-2-enoxyiminomethyl]phenyl]-2-methylfuran-3-carbothioamide.
Chemical Property Profile of UC57
Property Insights of UC57
The XLogP value of 4.56552 indicates that UC57 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.76 Ų, UC57 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UC57 has 1 hydrogen bond donor(s) and 4 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 UC57?
The CAS number of UC57 is 172998-58-2.
What is the molecular formula of UC57?
The molecular formula of UC57 is C16H15ClN2O2S.
What is the molecular weight of UC57?
The molecular weight of UC57 is 334.05 g/mol.
Where can I buy UC57?
You can request a quote for UC57 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UC57?
Yes, KEHONG BIO provides custom synthesis services for UC57 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.