![3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic Acid structure](/static/products/4468/446852-19-3.webp)
3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic Acid
TL;DR: 3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic Acid (CAS 446852-19-3) is a chemical compound with molecular formula C16H13N5O3S and molecular weight 355.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic acid
Also Known As: CBKinase1_008637, CBKinase1_021037, AB01281128-01, 3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic Acid, BRD-K31548071-001-01-8
| Molecular Formula | C16H13N5O3S |
|---|---|
| Molecular Weight | 355.07 g/mol |
| LogP | 2.0913 |
| Topological Polar Surface Area | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 355.0739 |
| Heavy Atoms | 25 |
| Complexity | 897.55054 |
Chemical Identifiers
| CAS Number | 446852-19-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=N2)SCC(=O)NC3=CC=CC(=C3)C(=O)O |
Product Overview
3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic Acid (CAS 446852-19-3), with molecular formula C16H13N5O3S and molecular weight 355.07 g/mol. IUPAC: 3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic acid.
Chemical Property Profile of 3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic Acid
Property Insights of 3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic Acid
The XLogP value of 2.0913 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic Acid. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic Acid. Following Lipinski's Rule of Five, 3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic Acid 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 3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic Acid?
The CAS number of 3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic Acid is 446852-19-3.
What is the molecular formula of 3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic Acid?
The molecular formula of 3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic Acid is C16H13N5O3S.
What is the molecular weight of 3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic Acid?
The molecular weight of 3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic Acid is 355.07 g/mol.
Where can I buy 3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic Acid?
You can request a quote for 3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.