Benzamide,2,5-dichloro-3-nitro-N-2-thiazolyl-
TL;DR: Benzamide,2,5-dichloro-3-nitro-N-2-thiazolyl- (CAS 6998-23-8) is a chemical compound with molecular formula C37H32N4O6S and molecular weight 660.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-(4-methoxycarbonylphenyl)-7-methyl-3-oxo-2-[[1-phenyl-3-(4-prop-2-enoxyphenyl)pyrazol-4-yl]methylidene]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Also Known As: Benzamide,2,5-dichloro-3-nitro-N-2-thiazolyl-, Ethyl 5-[4-(methoxycarbonyl)phenyl]-7-methyl-3-oxo-2-[(1-phenyl-3-{4-[(prop-2-en-1-yl)oxy]phenyl}-1H-pyrazol-4-yl)methylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate, ethyl 5-(4-methoxycarbonylphenyl)-7-methyl-3-oxo-2-[[1-phenyl-3-(4-prop-2-enoxyphenyl)pyrazol-4-yl]methylidene]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
| Molecular Formula | C37H32N4O6S |
|---|---|
| Molecular Weight | 660.20 g/mol |
| LogP | 5.0024 |
| Topological Polar Surface Area | 114.01 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 660.2043 |
| Heavy Atoms | 48 |
| Complexity | 2212.1526 |
Chemical Identifiers
| CAS Number | 6998-23-8 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C(=O)OC)C(=O)C(=CC4=CN(N=C4C5=CC=C(C=C5)OCC=C)C6=CC=CC=C6)S2)C |
Product Overview
Benzamide,2,5-dichloro-3-nitro-N-2-thiazolyl- (CAS 6998-23-8), with molecular formula C37H32N4O6S and molecular weight 660.20 g/mol. IUPAC: ethyl 5-(4-methoxycarbonylphenyl)-7-methyl-3-oxo-2-[[1-phenyl-3-(4-prop-2-enoxyphenyl)pyrazol-4-yl]methylidene]-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate.
Chemical Property Profile of Benzamide,2,5-dichloro-3-nitro-N-2-thiazolyl-
Property Insights of Benzamide,2,5-dichloro-3-nitro-N-2-thiazolyl-
The XLogP value of 5.0024 indicates that Benzamide,2,5-dichloro-3-nitro-N-2-thiazolyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.01 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzamide,2,5-dichloro-3-nitro-N-2-thiazolyl-. Following Lipinski's Rule of Five, Benzamide,2,5-dichloro-3-nitro-N-2-thiazolyl- 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 Benzamide,2,5-dichloro-3-nitro-N-2-thiazolyl-?
The CAS number of Benzamide,2,5-dichloro-3-nitro-N-2-thiazolyl- is 6998-23-8.
What is the molecular formula of Benzamide,2,5-dichloro-3-nitro-N-2-thiazolyl-?
The molecular formula of Benzamide,2,5-dichloro-3-nitro-N-2-thiazolyl- is C37H32N4O6S.
What is the molecular weight of Benzamide,2,5-dichloro-3-nitro-N-2-thiazolyl-?
The molecular weight of Benzamide,2,5-dichloro-3-nitro-N-2-thiazolyl- is 660.20 g/mol.
Where can I buy Benzamide,2,5-dichloro-3-nitro-N-2-thiazolyl-?
You can request a quote for Benzamide,2,5-dichloro-3-nitro-N-2-thiazolyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzamide,2,5-dichloro-3-nitro-N-2-thiazolyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzamide,2,5-dichloro-3-nitro-N-2-thiazolyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.