![4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid structure](/static/products/3549/354994-01-7.webp)
4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid
TL;DR: 4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid (CAS 354994-01-7) is a chemical compound with molecular formula C14H15N5O2 and molecular weight 285.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid
Also Known As: 4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid, BAS 01921883, 4-(3-(4,6-dimethylpyrimidin-2-yl)guanidino)benzoic acid, 4-[N'-(4,6-Dimethyl-pyrimidin-2-yl)-guanidino]-benzoic acid, 4-[n-(4,6-dimethyl-pyrimidin-2-yl)-guanidino]-benzoic acid
| Molecular Formula | C14H15N5O2 |
|---|---|
| Molecular Weight | 285.12 g/mol |
| LogP | 1.84994 |
| Topological Polar Surface Area | 113.49 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 285.1226 |
| Heavy Atoms | 21 |
| Complexity | 674.7606 |
Chemical Identifiers
| CAS Number | 354994-01-7 |
|---|---|
| SMILES | CC1=CC(=NC(=N1)N=C(N)NC2=CC=C(C=C2)C(=O)O)C |
Product Overview
4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid (CAS 354994-01-7), with molecular formula C14H15N5O2 and molecular weight 285.12 g/mol. IUPAC: 4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid.
Chemical Property Profile of 4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid
Property Insights of 4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid
The XLogP value of 1.84994 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid. The TPSA of 113.49 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid. Following Lipinski's Rule of Five, 4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid has 3 hydrogen bond donor(s) and 4 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-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid?
The CAS number of 4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid is 354994-01-7.
What is the molecular formula of 4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid?
The molecular formula of 4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid is C14H15N5O2.
What is the molecular weight of 4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid?
The molecular weight of 4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid is 285.12 g/mol.
Where can I buy 4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid?
You can request a quote for 4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]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 4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[[N'-(4,6-dimethylpyrimidin-2-yl)carbamimidoyl]amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.