3-(Carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid
TL;DR: 3-(Carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid (CAS 1195628-02-4) is a chemical compound with molecular formula C11H15N3O5S and molecular weight 301.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid
Also Known As: beta-Ureido-L-alpha-tosylaminopropionic Acid, A-Ureido-L-, A-tosylaminopropionic Acid, beta-Ureido-D-alpha-tosylaminopropionic Acid, 3-(carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid
| Molecular Formula | C11H15N3O5S |
|---|---|
| Molecular Weight | 301.07 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 301.07324 |
| Heavy Atoms | 20 |
| Complexity | 451.0 |
Chemical Identifiers
| CAS Number | 1195628-02-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC(CNC(=O)N)C(=O)O |
| InChIKey | LCZLWCJYNPNMDN-UHFFFAOYSA-N |
Product Overview
3-(Carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid (CAS 1195628-02-4), with molecular formula C11H15N3O5S and molecular weight 301.07 g/mol. IUPAC: 3-(carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid.
Chemical Property Profile of 3-(Carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid
Property Insights of 3-(Carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid
The XLogP value of -0.4 indicates that 3-(Carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 147.0 Ų indicates high polarity, suggesting 3-(Carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-(Carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid has 4 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-(Carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid?
The CAS number of 3-(Carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid is 1195628-02-4.
What is the molecular formula of 3-(Carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid?
The molecular formula of 3-(Carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid is C11H15N3O5S.
What is the molecular weight of 3-(Carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid?
The molecular weight of 3-(Carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid is 301.07 g/mol.
Where can I buy 3-(Carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid?
You can request a quote for 3-(Carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(Carbamoylamino)-2-[(4-methylphenyl)sulfonylamino]propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.