![4-tert-butyl-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide structure](/static/products/895/895847-07-1.png)
4-tert-butyl-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
TL;DR: 4-tert-butyl-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide (CAS 895847-07-1) is a chemical compound with molecular formula C16H21N3O3S2 and molecular weight 367.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-N-(5-propylsulfonyl-1,3,4-thiadiazol-2-yl)benzamide
Also Known As: 4-tert-butyl-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide, 4-(tert-butyl)-N-(5-(propylsulfonyl)-1,3,4-thiadiazol-2-yl)benzamide, 4-tert-butyl-N-(5-propylsulfonyl-1,3,4-thiadiazol-2-yl)benzamide
| Molecular Formula | C16H21N3O3S2 |
|---|---|
| Molecular Weight | 367.10 g/mol |
| LogP | 3.2716 |
| Topological Polar Surface Area | 89.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 367.10245 |
| Heavy Atoms | 24 |
| Complexity | 818.9977 |
Chemical Identifiers
| CAS Number | 895847-07-1 |
|---|---|
| SMILES | CCCS(=O)(=O)C1=NN=C(S1)NC(=O)C2=CC=C(C=C2)C(C)(C)C |
Product Overview
4-tert-butyl-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide (CAS 895847-07-1), with molecular formula C16H21N3O3S2 and molecular weight 367.10 g/mol. IUPAC: 4-tert-butyl-N-(5-propylsulfonyl-1,3,4-thiadiazol-2-yl)benzamide.
Chemical Property Profile of 4-tert-butyl-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
Property Insights of 4-tert-butyl-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide
The XLogP value of 3.2716 indicates that 4-tert-butyl-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.02 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-tert-butyl-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide. Following Lipinski's Rule of Five, 4-tert-butyl-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide 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 4-tert-butyl-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide?
The CAS number of 4-tert-butyl-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide is 895847-07-1.
What is the molecular formula of 4-tert-butyl-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide?
The molecular formula of 4-tert-butyl-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide is C16H21N3O3S2.
What is the molecular weight of 4-tert-butyl-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide?
The molecular weight of 4-tert-butyl-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide is 367.10 g/mol.
Where can I buy 4-tert-butyl-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide?
You can request a quote for 4-tert-butyl-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-tert-butyl-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-tert-butyl-N-[(2Z)-5-(propylsulfonyl)-1,3,4-thiadiazol-2(3H)-ylidene]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.