Asaphan
TL;DR: Asaphan (CAS 10065-57-3) is a chemical compound with molecular formula C26H33Cl2N3O4 and molecular weight 521.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-acetamido-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoyl]amino]-3-phenylpropanoate
Also Known As: Asaphan, Asafan, DL,DL-Asaphan, BAS 00380203, Ethyl ester of N-acetyl-DL-sarcolysyl-L-phenylalanine
| Molecular Formula | C26H33Cl2N3O4 |
|---|---|
| Molecular Weight | 521.18 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 87.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 15 |
| Exact Mass | 521.1848 |
| Heavy Atoms | 35 |
| Complexity | 647.0 |
Chemical Identifiers
| CAS Number | 10065-57-3 |
|---|---|
| SMILES | CCOC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC2=CC=C(C=C2)N(CCCl)CCCl)NC(=O)C |
| InChIKey | SPTPIOQJNAVKCR-UHFFFAOYSA-N |
Product Overview
Asaphan (CAS 10065-57-3), with molecular formula C26H33Cl2N3O4 and molecular weight 521.18 g/mol. IUPAC: ethyl 2-[[2-acetamido-3-[4-[bis(2-chloroethyl)amino]phenyl]propanoyl]amino]-3-phenylpropanoate.
Chemical Property Profile of Asaphan
Property Insights of Asaphan
The XLogP value of 3.5 indicates that Asaphan is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Asaphan. Following Lipinski's Rule of Five, Asaphan has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Asaphan?
The CAS number of Asaphan is 10065-57-3.
What is the molecular formula of Asaphan?
The molecular formula of Asaphan is C26H33Cl2N3O4.
What is the molecular weight of Asaphan?
The molecular weight of Asaphan is 521.18 g/mol.
Where can I buy Asaphan?
You can request a quote for Asaphan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Asaphan?
Yes, KEHONG BIO provides custom synthesis services for Asaphan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.