Dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate
TL;DR: Dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate (CAS 73984-07-3) is a chemical compound with molecular formula C25H25NO6S and molecular weight 467.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate
Also Known As: dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate, Dibenzyl N-(4-methylbenzene-1-sulfonyl)aspartate
| Molecular Formula | C25H25NO6S |
|---|---|
| Molecular Weight | 467.14 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 12 |
| Exact Mass | 467.14026 |
| Heavy Atoms | 33 |
| Complexity | 714.0 |
Chemical Identifiers
| CAS Number | 73984-07-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC(CC(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3 |
| InChIKey | BRPMKJPZZZOLEE-UHFFFAOYSA-N |
Product Overview
Dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate (CAS 73984-07-3), with molecular formula C25H25NO6S and molecular weight 467.14 g/mol. IUPAC: dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate.
Chemical Property Profile of Dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate
Property Insights of Dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate
The XLogP value of 4.0 indicates that Dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate. Following Lipinski's Rule of Five, Dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate has 1 hydrogen bond donor(s) and 7 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 Dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate?
The CAS number of Dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate is 73984-07-3.
What is the molecular formula of Dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate?
The molecular formula of Dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate is C25H25NO6S.
What is the molecular weight of Dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate?
The molecular weight of Dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate is 467.14 g/mol.
Where can I buy Dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate?
You can request a quote for Dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate?
Yes, KEHONG BIO provides custom synthesis services for Dibenzyl 2-[(4-methylphenyl)sulfonylamino]butanedioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.