N1-(3,4-dimethoxyphenethyl)-N4-(5-isobutyl-1,3,4-thiadiazol-2-yl)succinamide
TL;DR: N1-(3,4-dimethoxyphenethyl)-N4-(5-isobutyl-1,3,4-thiadiazol-2-yl)succinamide (CAS 714232-20-9) is a chemical compound with molecular formula C20H28N4O4S and molecular weight 420.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanediamide
Also Known As: N1-(3,4-dimethoxyphenethyl)-N4-(5-isobutyl-1,3,4-thiadiazol-2-yl)succinamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-[(2E)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanediamide
| Molecular Formula | C20H28N4O4S |
|---|---|
| Molecular Weight | 420.18 g/mol |
| LogP | 2.8314 |
| Topological Polar Surface Area | 102.44 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 420.18314 |
| Heavy Atoms | 29 |
| Complexity | 822.56256 |
Chemical Identifiers
| CAS Number | 714232-20-9 |
|---|---|
| SMILES | CC(C)CC1=NN=C(S1)NC(=O)CCC(=O)NCCC2=CC(=C(C=C2)OC)OC |
Product Overview
N1-(3,4-dimethoxyphenethyl)-N4-(5-isobutyl-1,3,4-thiadiazol-2-yl)succinamide (CAS 714232-20-9), with molecular formula C20H28N4O4S and molecular weight 420.18 g/mol. IUPAC: N-[2-(3,4-dimethoxyphenyl)ethyl]-N'-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanediamide.
Chemical Property Profile of N1-(3,4-dimethoxyphenethyl)-N4-(5-isobutyl-1,3,4-thiadiazol-2-yl)succinamide
Property Insights of N1-(3,4-dimethoxyphenethyl)-N4-(5-isobutyl-1,3,4-thiadiazol-2-yl)succinamide
The XLogP value of 2.8314 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N1-(3,4-dimethoxyphenethyl)-N4-(5-isobutyl-1,3,4-thiadiazol-2-yl)succinamide. The TPSA of 102.44 Ų falls within the moderate polarity range, balancing permeability and solubility for N1-(3,4-dimethoxyphenethyl)-N4-(5-isobutyl-1,3,4-thiadiazol-2-yl)succinamide. Following Lipinski's Rule of Five, N1-(3,4-dimethoxyphenethyl)-N4-(5-isobutyl-1,3,4-thiadiazol-2-yl)succinamide 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 N1-(3,4-dimethoxyphenethyl)-N4-(5-isobutyl-1,3,4-thiadiazol-2-yl)succinamide?
The CAS number of N1-(3,4-dimethoxyphenethyl)-N4-(5-isobutyl-1,3,4-thiadiazol-2-yl)succinamide is 714232-20-9.
What is the molecular formula of N1-(3,4-dimethoxyphenethyl)-N4-(5-isobutyl-1,3,4-thiadiazol-2-yl)succinamide?
The molecular formula of N1-(3,4-dimethoxyphenethyl)-N4-(5-isobutyl-1,3,4-thiadiazol-2-yl)succinamide is C20H28N4O4S.
What is the molecular weight of N1-(3,4-dimethoxyphenethyl)-N4-(5-isobutyl-1,3,4-thiadiazol-2-yl)succinamide?
The molecular weight of N1-(3,4-dimethoxyphenethyl)-N4-(5-isobutyl-1,3,4-thiadiazol-2-yl)succinamide is 420.18 g/mol.
Where can I buy N1-(3,4-dimethoxyphenethyl)-N4-(5-isobutyl-1,3,4-thiadiazol-2-yl)succinamide?
You can request a quote for N1-(3,4-dimethoxyphenethyl)-N4-(5-isobutyl-1,3,4-thiadiazol-2-yl)succinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1-(3,4-dimethoxyphenethyl)-N4-(5-isobutyl-1,3,4-thiadiazol-2-yl)succinamide?
Yes, KEHONG BIO provides custom synthesis services for N1-(3,4-dimethoxyphenethyl)-N4-(5-isobutyl-1,3,4-thiadiazol-2-yl)succinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.