2-(N-benzylcarbamimidamido)acetic acid
TL;DR: 2-(N-benzylcarbamimidamido)acetic acid (CAS 35404-63-8) is a chemical compound with molecular formula C10H13N3O2 and molecular weight 207.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[benzyl(carbamimidoyl)amino]acetic acid
Also Known As: 2-(1-Benzylguanidino)acetic acid, 2-[benzyl(carbamimidoyl)amino]acetic acid, N-Benzyl-N-carbamimidoylglycine, 2-(N-benzylcarbamimidamido)acetic acid, 2-(1-Benzylguanidino)aceticacid
| Molecular Formula | C10H13N3O2 |
|---|---|
| Molecular Weight | 207.10 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 90.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 207.10077 |
| Heavy Atoms | 15 |
| Complexity | 237.0 |
Chemical Identifiers
| CAS Number | 35404-63-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN(CC(=O)O)C(=N)N |
| InChIKey | DRCHOONPCUVLOU-UHFFFAOYSA-N |
Product Overview
2-(N-benzylcarbamimidamido)acetic acid (CAS 35404-63-8), with molecular formula C10H13N3O2 and molecular weight 207.10 g/mol. IUPAC: 2-[benzyl(carbamimidoyl)amino]acetic acid.
Chemical Property Profile of 2-(N-benzylcarbamimidamido)acetic acid
Property Insights of 2-(N-benzylcarbamimidamido)acetic acid
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(N-benzylcarbamimidamido)acetic acid. The TPSA of 90.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(N-benzylcarbamimidamido)acetic acid. Following Lipinski's Rule of Five, 2-(N-benzylcarbamimidamido)acetic acid has 3 hydrogen bond donor(s) and 3 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 2-(N-benzylcarbamimidamido)acetic acid?
The CAS number of 2-(N-benzylcarbamimidamido)acetic acid is 35404-63-8.
What is the molecular formula of 2-(N-benzylcarbamimidamido)acetic acid?
The molecular formula of 2-(N-benzylcarbamimidamido)acetic acid is C10H13N3O2.
What is the molecular weight of 2-(N-benzylcarbamimidamido)acetic acid?
The molecular weight of 2-(N-benzylcarbamimidamido)acetic acid is 207.10 g/mol.
Where can I buy 2-(N-benzylcarbamimidamido)acetic acid?
You can request a quote for 2-(N-benzylcarbamimidamido)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(N-benzylcarbamimidamido)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(N-benzylcarbamimidamido)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.