4-[5-[2-(Tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzamide
TL;DR: 4-[5-[2-(Tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzamide (CAS 346465-21-2) is a chemical compound with molecular formula C14H18N6O2S and molecular weight 334.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[5-[2-(tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzamide
Also Known As: BAS 03818815, 4-[5-[2-(tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzamide, 4-[5-(tert-Butylcarbamoyl-methylsulfanyl)-tetrazol-1-yl]-benzamide, 4-(5-((2-(tert-butylamino)-2-oxoethyl)thio)-1H-tetrazol-1-yl)benzamide, 4-(5-{[(TERT-BUTYLCARBAMOYL)METHYL]SULFANYL}-1H-1,2,3,4-TETRAZOL-1-YL)BENZAMIDE
| Molecular Formula | C14H18N6O2S |
|---|---|
| Molecular Weight | 334.12 g/mol |
| LogP | 0.768 |
| Topological Polar Surface Area | 115.79 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 334.1212 |
| Heavy Atoms | 23 |
| Complexity | 704.80273 |
Chemical Identifiers
| CAS Number | 346465-21-2 |
|---|---|
| SMILES | CC(C)(C)NC(=O)CSC1=NN=NN1C2=CC=C(C=C2)C(=O)N |
Product Overview
4-[5-[2-(Tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzamide (CAS 346465-21-2), with molecular formula C14H18N6O2S and molecular weight 334.12 g/mol. IUPAC: 4-[5-[2-(tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzamide.
Chemical Property Profile of 4-[5-[2-(Tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzamide
Property Insights of 4-[5-[2-(Tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzamide
The XLogP value of 0.768 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[5-[2-(Tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzamide. The TPSA of 115.79 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[5-[2-(Tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzamide. Following Lipinski's Rule of Five, 4-[5-[2-(Tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzamide has 2 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-[5-[2-(Tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzamide?
The CAS number of 4-[5-[2-(Tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzamide is 346465-21-2.
What is the molecular formula of 4-[5-[2-(Tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzamide?
The molecular formula of 4-[5-[2-(Tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzamide is C14H18N6O2S.
What is the molecular weight of 4-[5-[2-(Tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzamide?
The molecular weight of 4-[5-[2-(Tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzamide is 334.12 g/mol.
Where can I buy 4-[5-[2-(Tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzamide?
You can request a quote for 4-[5-[2-(Tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-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-[5-[2-(Tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 4-[5-[2-(Tert-butylamino)-2-oxoethyl]sulfanyltetrazol-1-yl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.