![3-[5-(4-Chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one structure](/static/products/3643/364341-39-9.webp)
3-[5-(4-Chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one
TL;DR: 3-[5-(4-Chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one (CAS 364341-39-9) is a chemical compound with molecular formula C21H19ClN4O2S and molecular weight 426.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-(4-chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one
Also Known As: 3-[5-(4-chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one, 3-{5-[(4-chlorophenyl)amino]-1,3,4-thiadiazol-2-yl}-7-(diethylamino)-2H-chromen-2-one
| Molecular Formula | C21H19ClN4O2S |
|---|---|
| Molecular Weight | 426.09 g/mol |
| LogP | 5.5547 |
| Topological Polar Surface Area | 71.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.09174 |
| Heavy Atoms | 29 |
| Complexity | 1199.5084 |
Chemical Identifiers
| CAS Number | 364341-39-9 |
|---|---|
| SMILES | CCN(CC)C1=CC2=C(C=C1)C=C(C(=O)O2)C3=NN=C(S3)NC4=CC=C(C=C4)Cl |
Product Overview
3-[5-(4-Chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one (CAS 364341-39-9), with molecular formula C21H19ClN4O2S and molecular weight 426.09 g/mol. IUPAC: 3-[5-(4-chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one.
Chemical Property Profile of 3-[5-(4-Chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one
Property Insights of 3-[5-(4-Chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one
The XLogP value of 5.5547 indicates that 3-[5-(4-Chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.26 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[5-(4-Chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one. Following Lipinski's Rule of Five, 3-[5-(4-Chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-[5-(4-Chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one?
The CAS number of 3-[5-(4-Chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one is 364341-39-9.
What is the molecular formula of 3-[5-(4-Chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one?
The molecular formula of 3-[5-(4-Chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one is C21H19ClN4O2S.
What is the molecular weight of 3-[5-(4-Chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one?
The molecular weight of 3-[5-(4-Chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one is 426.09 g/mol.
Where can I buy 3-[5-(4-Chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one?
You can request a quote for 3-[5-(4-Chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[5-(4-Chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[5-(4-Chloroanilino)-1,3,4-thiadiazol-2-yl]-7-(diethylamino)chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.