N-(4-Amino-4-deoxy-N-methylpteroyl)-4-aminobutanesulfonic acid
TL;DR: N-(4-Amino-4-deoxy-N-methylpteroyl)-4-aminobutanesulfonic acid (CAS 114149-60-9) is a chemical compound with molecular formula C19H24N8O4S and molecular weight 460.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]butane-1-sulfonic acid
Also Known As: N-(4-Amino-4-deoxy-N-methylpteroyl)-4-aminobutanesulfonic acid, 1-butanesulfonic acid, 4-[[4-[[(2,4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]amino]-, 1-Butanesulfonic acid,4-[[4-[[(2,4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]amino]-, 4-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]butane-1-sulfonic acid, 1-Butanesulfonic acid,4-[[4-[[(2,4-diamino-6-pteridinyl)methyl]methylamino]benzoyl]amino]
| Molecular Formula | C19H24N8O4S |
|---|---|
| Molecular Weight | 460.16 g/mol |
| LogP | -1.7 |
| Topological Polar Surface Area | 199.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 9 |
| Exact Mass | 460.16412 |
| Heavy Atoms | 32 |
| Complexity | 713.0 |
Chemical Identifiers
| CAS Number | 114149-60-9 |
|---|---|
| SMILES | CN(CC1=CN=C2C(=N1)C(=NC(=N2)N)N)C3=CC=C(C=C3)C(=O)NCCCCS(=O)(=O)O |
| InChIKey | JWLXZKNMSUFNOS-UHFFFAOYSA-N |
Product Overview
N-(4-Amino-4-deoxy-N-methylpteroyl)-4-aminobutanesulfonic acid (CAS 114149-60-9), with molecular formula C19H24N8O4S and molecular weight 460.16 g/mol. IUPAC: 4-[[4-[(2,4-diaminopteridin-6-yl)methyl-methylamino]benzoyl]amino]butane-1-sulfonic acid.
Chemical Property Profile of N-(4-Amino-4-deoxy-N-methylpteroyl)-4-aminobutanesulfonic acid
Property Insights of N-(4-Amino-4-deoxy-N-methylpteroyl)-4-aminobutanesulfonic acid
The XLogP value of -1.7 indicates that N-(4-Amino-4-deoxy-N-methylpteroyl)-4-aminobutanesulfonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 199.0 Ų indicates high polarity, suggesting N-(4-Amino-4-deoxy-N-methylpteroyl)-4-aminobutanesulfonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(4-Amino-4-deoxy-N-methylpteroyl)-4-aminobutanesulfonic acid has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(4-Amino-4-deoxy-N-methylpteroyl)-4-aminobutanesulfonic acid?
The CAS number of N-(4-Amino-4-deoxy-N-methylpteroyl)-4-aminobutanesulfonic acid is 114149-60-9.
What is the molecular formula of N-(4-Amino-4-deoxy-N-methylpteroyl)-4-aminobutanesulfonic acid?
The molecular formula of N-(4-Amino-4-deoxy-N-methylpteroyl)-4-aminobutanesulfonic acid is C19H24N8O4S.
What is the molecular weight of N-(4-Amino-4-deoxy-N-methylpteroyl)-4-aminobutanesulfonic acid?
The molecular weight of N-(4-Amino-4-deoxy-N-methylpteroyl)-4-aminobutanesulfonic acid is 460.16 g/mol.
Where can I buy N-(4-Amino-4-deoxy-N-methylpteroyl)-4-aminobutanesulfonic acid?
You can request a quote for N-(4-Amino-4-deoxy-N-methylpteroyl)-4-aminobutanesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-Amino-4-deoxy-N-methylpteroyl)-4-aminobutanesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for N-(4-Amino-4-deoxy-N-methylpteroyl)-4-aminobutanesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.