UNIROYAL ANALOG
TL;DR: UNIROYAL ANALOG (CAS 165391-80-0) is a chemical compound with molecular formula C16H17ClN2O2S and molecular weight 336.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-chloro-3-[(E)-propan-2-yloxyiminomethyl]phenyl]-2-methylfuran-3-carbothioamide
Also Known As: UNIROYAL ANALOG, 3-Furancarbothioamide der., 2-Methyl-furan-3-carbothioic acid, (4-chloro-3-(isopropoxyimino-methyl)-phenyl)-amide, 3-Furancarbothioamide, N-(4-chloro-3-(((1-methylethoxy)imino)methyl)phenyl)-2-methyl-, 3-Furancarbothioamide, N-[[4-chloro-3-(1-methylethoxy) imino]- phenyl]-
| Molecular Formula | C16H17ClN2O2S |
|---|---|
| Molecular Weight | 336.07 g/mol |
| LogP | 4.78792 |
| Topological Polar Surface Area | 46.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 336.06992 |
| Heavy Atoms | 22 |
| Complexity | 695.2043 |
Chemical Identifiers
| CAS Number | 165391-80-0 |
|---|---|
| SMILES | CC1=C(C=CO1)C(=S)NC2=CC(=C(C=C2)Cl)/C=N/OC(C)C |
Product Overview
UNIROYAL ANALOG (CAS 165391-80-0), with molecular formula C16H17ClN2O2S and molecular weight 336.07 g/mol. IUPAC: N-[4-chloro-3-[(E)-propan-2-yloxyiminomethyl]phenyl]-2-methylfuran-3-carbothioamide.
Chemical Property Profile of UNIROYAL ANALOG
Property Insights of UNIROYAL ANALOG
The XLogP value of 4.78792 indicates that UNIROYAL ANALOG is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.76 Ų, UNIROYAL ANALOG exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UNIROYAL ANALOG 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 UNIROYAL ANALOG?
The CAS number of UNIROYAL ANALOG is 165391-80-0.
What is the molecular formula of UNIROYAL ANALOG?
The molecular formula of UNIROYAL ANALOG is C16H17ClN2O2S.
What is the molecular weight of UNIROYAL ANALOG?
The molecular weight of UNIROYAL ANALOG is 336.07 g/mol.
Where can I buy UNIROYAL ANALOG?
You can request a quote for UNIROYAL ANALOG directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UNIROYAL ANALOG?
Yes, KEHONG BIO provides custom synthesis services for UNIROYAL ANALOG and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.