3,4-Dichloro-5-nitro-pyridin
TL;DR: 3,4-Dichloro-5-nitro-pyridin (CAS 5681-35-6) is a chemical compound with molecular formula C34H33ClN2O7S and molecular weight 648.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl]methylidene]-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: 3,4-Dichloro-5-nitro-pyridin, ethyl 2-[[4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl]methylidene]-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ETHYL (8Z)-8-[[4-[(4-CHLOROPHENYL)METHOXY]-3-ETHOXY-PHENYL]METHYLIDENE]-2-(3,4-DIMETHOXYPHENYL)-4-METHYL-9-OXO-7-THIA-1,5-DIAZABICYCLO[4.3.0]NONA-3,5-DIENE-3-CARBOXYLATE, Ethyl 2-({4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl}methylidene)-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C34H33ClN2O7S |
|---|---|
| Molecular Weight | 648.17 g/mol |
| LogP | 5.4466 |
| Topological Polar Surface Area | 97.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 648.1697 |
| Heavy Atoms | 45 |
| Complexity | 1929.2256 |
Chemical Identifiers
| CAS Number | 5681-35-6 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OCC)C4=CC(=C(C=C4)OC)OC)OCC5=CC=C(C=C5)Cl |
Product Overview
3,4-Dichloro-5-nitro-pyridin (CAS 5681-35-6), with molecular formula C34H33ClN2O7S and molecular weight 648.17 g/mol. IUPAC: ethyl 2-[[4-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl]methylidene]-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of 3,4-Dichloro-5-nitro-pyridin
Property Insights of 3,4-Dichloro-5-nitro-pyridin
The XLogP value of 5.4466 indicates that 3,4-Dichloro-5-nitro-pyridin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 97.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4-Dichloro-5-nitro-pyridin. Following Lipinski's Rule of Five, 3,4-Dichloro-5-nitro-pyridin has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,4-Dichloro-5-nitro-pyridin?
The CAS number of 3,4-Dichloro-5-nitro-pyridin is 5681-35-6.
What is the molecular formula of 3,4-Dichloro-5-nitro-pyridin?
The molecular formula of 3,4-Dichloro-5-nitro-pyridin is C34H33ClN2O7S.
What is the molecular weight of 3,4-Dichloro-5-nitro-pyridin?
The molecular weight of 3,4-Dichloro-5-nitro-pyridin is 648.17 g/mol.
Where can I buy 3,4-Dichloro-5-nitro-pyridin?
You can request a quote for 3,4-Dichloro-5-nitro-pyridin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Dichloro-5-nitro-pyridin?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dichloro-5-nitro-pyridin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.