1a09
TL;DR: 1a09 (CAS 1143579-76-3) is a chemical compound with molecular formula C27H44N3O10P and molecular weight 601.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4S)-4-[[(2S)-2-acetamido-3-[3-(hydroxymethyl)-4-phosphonooxyphenyl]propanoyl]amino]-5-(dipentylamino)-5-oxopentanoic acid
Also Known As: 1a09, 1-A09, (4S)-4-[[(2S)-2-acetamido-3-[3-(hydroxymethyl)-4-phosphonooxyphenyl]propanoyl]amino]-5-(dipentylamino)-5-oxopentanoic acid
| Molecular Formula | C27H44N3O10P |
|---|---|
| Molecular Weight | 601.28 g/mol |
| LogP | 2.2562 |
| Topological Polar Surface Area | 202.8 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 20 |
| Exact Mass | 601.2764 |
| Heavy Atoms | 41 |
| Complexity | 1051.7775 |
Chemical Identifiers
| CAS Number | 1143579-76-3 |
|---|---|
| SMILES | CCCCCN(CCCCC)C(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC1=CC(=C(C=C1)OP(=O)(O)O)CO)NC(=O)C |
Product Overview
1a09 (CAS 1143579-76-3), with molecular formula C27H44N3O10P and molecular weight 601.28 g/mol. IUPAC: (4S)-4-[[(2S)-2-acetamido-3-[3-(hydroxymethyl)-4-phosphonooxyphenyl]propanoyl]amino]-5-(dipentylamino)-5-oxopentanoic acid.
Chemical Property Profile of 1a09
Property Insights of 1a09
The XLogP value of 2.2562 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1a09. The TPSA of 202.8 Ų indicates high polarity, suggesting 1a09 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1a09 has 6 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1a09?
The CAS number of 1a09 is 1143579-76-3.
What is the molecular formula of 1a09?
The molecular formula of 1a09 is C27H44N3O10P.
What is the molecular weight of 1a09?
The molecular weight of 1a09 is 601.28 g/mol.
Where can I buy 1a09?
You can request a quote for 1a09 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1a09?
Yes, KEHONG BIO provides custom synthesis services for 1a09 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.