(E)-3-(4-chlorophenyl)-N-(5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl)acrylamide
TL;DR: (E)-3-(4-chlorophenyl)-N-(5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl)acrylamide (CAS 600151-44-8) is a chemical compound with molecular formula C20H18ClN3O3S and molecular weight 415.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(4-chlorophenyl)-N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]prop-2-enamide
Also Known As: (E)-3-(4-chlorophenyl)-N-(5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl)acrylamide, (2E)-3-(4-chlorophenyl)-N-[(2Z)-5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2(3H)-ylidene]prop-2-enamide, (E)-3-(4-chlorophenyl)-N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]prop-2-enamide
| Molecular Formula | C20H18ClN3O3S |
|---|---|
| Molecular Weight | 415.08 g/mol |
| LogP | 4.4514 |
| Topological Polar Surface Area | 73.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 415.07574 |
| Heavy Atoms | 28 |
| Complexity | 986.6159 |
Chemical Identifiers
| CAS Number | 600151-44-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CC2=NN=C(S2)NC(=O)/C=C/C3=CC=C(C=C3)Cl)OC |
Product Overview
(E)-3-(4-chlorophenyl)-N-(5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl)acrylamide (CAS 600151-44-8), with molecular formula C20H18ClN3O3S and molecular weight 415.08 g/mol. IUPAC: (E)-3-(4-chlorophenyl)-N-[5-[(3,4-dimethoxyphenyl)methyl]-1,3,4-thiadiazol-2-yl]prop-2-enamide.
Chemical Property Profile of (E)-3-(4-chlorophenyl)-N-(5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl)acrylamide
Property Insights of (E)-3-(4-chlorophenyl)-N-(5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl)acrylamide
The XLogP value of 4.4514 indicates that (E)-3-(4-chlorophenyl)-N-(5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl)acrylamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.34 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-3-(4-chlorophenyl)-N-(5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl)acrylamide. Following Lipinski's Rule of Five, (E)-3-(4-chlorophenyl)-N-(5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl)acrylamide has 1 hydrogen bond donor(s) and 6 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 (E)-3-(4-chlorophenyl)-N-(5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl)acrylamide?
The CAS number of (E)-3-(4-chlorophenyl)-N-(5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl)acrylamide is 600151-44-8.
What is the molecular formula of (E)-3-(4-chlorophenyl)-N-(5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl)acrylamide?
The molecular formula of (E)-3-(4-chlorophenyl)-N-(5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl)acrylamide is C20H18ClN3O3S.
What is the molecular weight of (E)-3-(4-chlorophenyl)-N-(5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl)acrylamide?
The molecular weight of (E)-3-(4-chlorophenyl)-N-(5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl)acrylamide is 415.08 g/mol.
Where can I buy (E)-3-(4-chlorophenyl)-N-(5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl)acrylamide?
You can request a quote for (E)-3-(4-chlorophenyl)-N-(5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl)acrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(4-chlorophenyl)-N-(5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl)acrylamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(4-chlorophenyl)-N-(5-(3,4-dimethoxybenzyl)-1,3,4-thiadiazol-2-yl)acrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.