2,4-dichloro-5-isopropoxy-N-(1,3-thiazolan-2-yliden)aniline
TL;DR: 2,4-dichloro-5-isopropoxy-N-(1,3-thiazolan-2-yliden)aniline (CAS 400736-23-4) is a chemical compound with molecular formula C12H14Cl2N2OS and molecular weight 304.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,4-dichloro-5-propan-2-yloxyphenyl)-4,5-dihydro-1,3-thiazol-2-amine
Also Known As: 9L-521S, 2,4-dichloro-5-isopropoxy-N-(1,3-thiazolan-2-yliden)aniline, (2Z)-N-[2,4-dichloro-5-(propan-2-yloxy)phenyl]-1,3-thiazolidin-2-imine, N-(2,4-dichloro-5-propan-2-yloxyphenyl)-4,5-dihydro-1,3-thiazol-2-amine
| Molecular Formula | C12H14Cl2N2OS |
|---|---|
| Molecular Weight | 304.02 g/mol |
| LogP | 4.2953 |
| Topological Polar Surface Area | 33.62 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 304.0204 |
| Heavy Atoms | 18 |
| Complexity | 477.39038 |
Chemical Identifiers
| CAS Number | 400736-23-4 |
|---|---|
| SMILES | CC(C)OC1=C(C=C(C(=C1)NC2=NCCS2)Cl)Cl |
Product Overview
2,4-dichloro-5-isopropoxy-N-(1,3-thiazolan-2-yliden)aniline (CAS 400736-23-4), with molecular formula C12H14Cl2N2OS and molecular weight 304.02 g/mol. IUPAC: N-(2,4-dichloro-5-propan-2-yloxyphenyl)-4,5-dihydro-1,3-thiazol-2-amine.
Chemical Property Profile of 2,4-dichloro-5-isopropoxy-N-(1,3-thiazolan-2-yliden)aniline
Property Insights of 2,4-dichloro-5-isopropoxy-N-(1,3-thiazolan-2-yliden)aniline
The XLogP value of 4.2953 indicates that 2,4-dichloro-5-isopropoxy-N-(1,3-thiazolan-2-yliden)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.62 Ų, 2,4-dichloro-5-isopropoxy-N-(1,3-thiazolan-2-yliden)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-dichloro-5-isopropoxy-N-(1,3-thiazolan-2-yliden)aniline 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 2,4-dichloro-5-isopropoxy-N-(1,3-thiazolan-2-yliden)aniline?
The CAS number of 2,4-dichloro-5-isopropoxy-N-(1,3-thiazolan-2-yliden)aniline is 400736-23-4.
What is the molecular formula of 2,4-dichloro-5-isopropoxy-N-(1,3-thiazolan-2-yliden)aniline?
The molecular formula of 2,4-dichloro-5-isopropoxy-N-(1,3-thiazolan-2-yliden)aniline is C12H14Cl2N2OS.
What is the molecular weight of 2,4-dichloro-5-isopropoxy-N-(1,3-thiazolan-2-yliden)aniline?
The molecular weight of 2,4-dichloro-5-isopropoxy-N-(1,3-thiazolan-2-yliden)aniline is 304.02 g/mol.
Where can I buy 2,4-dichloro-5-isopropoxy-N-(1,3-thiazolan-2-yliden)aniline?
You can request a quote for 2,4-dichloro-5-isopropoxy-N-(1,3-thiazolan-2-yliden)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-dichloro-5-isopropoxy-N-(1,3-thiazolan-2-yliden)aniline?
Yes, KEHONG BIO provides custom synthesis services for 2,4-dichloro-5-isopropoxy-N-(1,3-thiazolan-2-yliden)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.