4-isopropoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide
TL;DR: 4-isopropoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide (CAS 476459-63-9) is a chemical compound with molecular formula C13H15N3O2S and molecular weight 277.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-propan-2-yloxybenzamide
Also Known As: UPCMLD0ENAT5830374:001, 4-isopropoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide, AB00668039-01, F0529-0166, N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-(propan-2-yloxy)benzamide
| Molecular Formula | C13H15N3O2S |
|---|---|
| Molecular Weight | 277.09 g/mol |
| LogP | 2.88602 |
| Topological Polar Surface Area | 64.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 277.0885 |
| Heavy Atoms | 19 |
| Complexity | 563.5222 |
Chemical Identifiers
| CAS Number | 476459-63-9 |
|---|---|
| SMILES | CC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)OC(C)C |
Product Overview
4-isopropoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide (CAS 476459-63-9), with molecular formula C13H15N3O2S and molecular weight 277.09 g/mol. IUPAC: N-(5-methyl-1,3,4-thiadiazol-2-yl)-4-propan-2-yloxybenzamide.
Chemical Property Profile of 4-isopropoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide
Property Insights of 4-isopropoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide
The XLogP value of 2.88602 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-isopropoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide. The TPSA of 64.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-isopropoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide. Following Lipinski's Rule of Five, 4-isopropoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide has 1 hydrogen bond donor(s) and 5 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-isopropoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide?
The CAS number of 4-isopropoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide is 476459-63-9.
What is the molecular formula of 4-isopropoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide?
The molecular formula of 4-isopropoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide is C13H15N3O2S.
What is the molecular weight of 4-isopropoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide?
The molecular weight of 4-isopropoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide is 277.09 g/mol.
Where can I buy 4-isopropoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide?
You can request a quote for 4-isopropoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-isopropoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-isopropoxy-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.