A1983/0083378
TL;DR: A1983/0083378 (CAS 337918-76-0) is a chemical compound with molecular formula C33H26N2O7S and molecular weight 594.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-[(Z)-[6-ethoxycarbonyl-5-(2-methoxynaphthalen-1-yl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-2-ylidene]methyl]furan-2-yl]benzoic acid
Also Known As: A1983/0083378, 3-{5-[(6-(ethoxycarbonyl)-5-(2-methoxy-1-naphthyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene)methyl]-2-furyl}benzoic acid, 3-[5-[(Z)-[6-ethoxycarbonyl-5-(2-methoxynaphthalen-1-yl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-2-ylidene]methyl]furan-2-yl]benzoic acid, (Z)-3-(5-((6-(ethoxycarbonyl)-5-(2-methoxynaphthalen-1-yl)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidin-2-ylidene)methyl)furan-2-yl)benzoic acid, 3-(5-{[(2Z)-6-(ETHOXYCARBONYL)-5-(2-METHOXYNAPHTHALEN-1-YL)-7-METHYL-3-OXO-2H,3H,5H-[1,3]THIAZOLO[3,2-A]PYRIMIDIN-2-YLIDENE]METHYL}FURAN-2-YL)BENZOIC ACID
| Molecular Formula | C33H26N2O7S |
|---|---|
| Molecular Weight | 594.15 g/mol |
| LogP | 4.9183 |
| Topological Polar Surface Area | 120.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 594.14606 |
| Heavy Atoms | 43 |
| Complexity | 2133.9937 |
Chemical Identifiers
| CAS Number | 337918-76-0 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2N(C1C3=C(C=CC4=CC=CC=C43)OC)C(=O)/C(=C/C5=CC=C(O5)C6=CC(=CC=C6)C(=O)O)/S2)C |
Product Overview
A1983/0083378 (CAS 337918-76-0), with molecular formula C33H26N2O7S and molecular weight 594.15 g/mol. IUPAC: 3-[5-[(Z)-[6-ethoxycarbonyl-5-(2-methoxynaphthalen-1-yl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-2-ylidene]methyl]furan-2-yl]benzoic acid.
Chemical Property Profile of A1983/0083378
Property Insights of A1983/0083378
The XLogP value of 4.9183 indicates that A1983/0083378 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 120.33 Ų falls within the moderate polarity range, balancing permeability and solubility for A1983/0083378. Following Lipinski's Rule of Five, A1983/0083378 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A1983/0083378?
The CAS number of A1983/0083378 is 337918-76-0.
What is the molecular formula of A1983/0083378?
The molecular formula of A1983/0083378 is C33H26N2O7S.
What is the molecular weight of A1983/0083378?
The molecular weight of A1983/0083378 is 594.15 g/mol.
Where can I buy A1983/0083378?
You can request a quote for A1983/0083378 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1983/0083378?
Yes, KEHONG BIO provides custom synthesis services for A1983/0083378 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.