1-(2-Methoxyphenyl)-3-(5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)urea
TL;DR: 1-(2-Methoxyphenyl)-3-(5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)urea (CAS 426237-24-3) is a chemical compound with molecular formula C16H13N5O4S and molecular weight 371.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-methoxyphenyl)-3-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]urea
Also Known As: AB00105811-01, 1-(2-methoxyphenyl)-3-(5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)urea, 1-(2-methoxyphenyl)-3-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]urea, N-(2-methoxyphenyl)-N'-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]urea, 1-(2-methoxyphenyl)-3-[(2Z)-5-(4-nitrophenyl)-1,3,4-thiadiazol-2(3H)-ylidene]urea
| Molecular Formula | C16H13N5O4S |
|---|---|
| Molecular Weight | 371.07 g/mol |
| LogP | 3.7659 |
| Topological Polar Surface Area | 119.28 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 371.06882 |
| Heavy Atoms | 26 |
| Complexity | 941.823 |
Chemical Identifiers
| CAS Number | 426237-24-3 |
|---|---|
| SMILES | COC1=CC=CC=C1NC(=O)NC2=NN=C(S2)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
1-(2-Methoxyphenyl)-3-(5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)urea (CAS 426237-24-3), with molecular formula C16H13N5O4S and molecular weight 371.07 g/mol. IUPAC: 1-(2-methoxyphenyl)-3-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]urea.
Chemical Property Profile of 1-(2-Methoxyphenyl)-3-(5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)urea
Property Insights of 1-(2-Methoxyphenyl)-3-(5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)urea
The XLogP value of 3.7659 indicates that 1-(2-Methoxyphenyl)-3-(5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Methoxyphenyl)-3-(5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)urea. Following Lipinski's Rule of Five, 1-(2-Methoxyphenyl)-3-(5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)urea has 2 hydrogen bond donor(s) and 7 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 1-(2-Methoxyphenyl)-3-(5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)urea?
The CAS number of 1-(2-Methoxyphenyl)-3-(5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)urea is 426237-24-3.
What is the molecular formula of 1-(2-Methoxyphenyl)-3-(5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)urea?
The molecular formula of 1-(2-Methoxyphenyl)-3-(5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)urea is C16H13N5O4S.
What is the molecular weight of 1-(2-Methoxyphenyl)-3-(5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)urea?
The molecular weight of 1-(2-Methoxyphenyl)-3-(5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)urea is 371.07 g/mol.
Where can I buy 1-(2-Methoxyphenyl)-3-(5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)urea?
You can request a quote for 1-(2-Methoxyphenyl)-3-(5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Methoxyphenyl)-3-(5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Methoxyphenyl)-3-(5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.