N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide
TL;DR: N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide (CAS 488827-52-7) is a chemical compound with molecular formula C12H14BrN5OS and molecular weight 355.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide
Also Known As: AQ-088/41137669, N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide, N-(4-bromophenyl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]butanamide, N-(4-bromophenyl)-2-((1-methyl-1H-tetrazol-5-yl)thio)butanamide, N-(4-bromophenyl)-2-[(1-methyl-1H-tetraazol-5-yl)sulfanyl]butanamide
| Molecular Formula | C12H14BrN5OS |
|---|---|
| Molecular Weight | 355.01 g/mol |
| LogP | 2.482 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 355.01025 |
| Heavy Atoms | 20 |
| Complexity | 585.7886 |
Chemical Identifiers
| CAS Number | 488827-52-7 |
|---|---|
| SMILES | CCC(C(=O)NC1=CC=C(C=C1)Br)SC2=NN=NN2C |
Product Overview
N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide (CAS 488827-52-7), with molecular formula C12H14BrN5OS and molecular weight 355.01 g/mol. IUPAC: N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide.
Chemical Property Profile of N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide
Property Insights of N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide
The XLogP value of 2.482 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide. Following Lipinski's Rule of Five, N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide 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 N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide?
The CAS number of N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide is 488827-52-7.
What is the molecular formula of N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide?
The molecular formula of N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide is C12H14BrN5OS.
What is the molecular weight of N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide?
The molecular weight of N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide is 355.01 g/mol.
Where can I buy N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide?
You can request a quote for N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-bromophenyl)-2-(1-methyltetrazol-5-yl)sulfanylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.