![环[DL-Aoda-DL-nTrp(OMe)-DL-xiIle-DL-Pip] structure](/static/products/1835/183506-66-3.webp)
环[DL-Aoda-DL-nTrp(OMe)-DL-xiIle-DL-Pip]
TL;DR: 环[DL-Aoda-DL-nTrp(OMe)-DL-xiIle-DL-Pip] (CAS 183506-66-3) is a chemical compound with molecular formula C33H47N5O6 and molecular weight 609.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
环[DL-Aoda-DL-nTrp(OMe)-DL-xiIle-DL-Pip]
3-butan-2-yl-6-(1-methoxyindol-3-yl)-9-(6-oxooctyl)-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone
Also Known As: apicidin, OSI 2040, 3-butan-2-yl-6-(1-methoxyindol-3-yl)-9-(6-oxooctyl)-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone, 9-(butan-2-yl)-6-(1-methoxy-1H-indol-3-yl)-3-(6-oxooctyl)octahydro-2H-pyrido[1,2-a][1,4,7,10]tetraazacyclododecine-1,4,7,10(3H,12H)-tetrone
| Molecular Formula | C33H47N5O6 |
|---|---|
| Molecular Weight | 609.35 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 609.35266 |
| Heavy Atoms | 44 |
| Complexity | 1040.0 |
Chemical Identifiers
| CAS Number | 183506-66-3 |
|---|---|
| SMILES | CCC(C)C1C(=O)N2CCCCC2C(=O)NC(C(=O)NC(C(=O)N1)C3=CN(C4=CC=CC=C43)OC)CCCCCC(=O)CC |
| InChIKey | XWKJTSOFFKCRMH-UHFFFAOYSA-N |
Product Overview
环[DL-Aoda-DL-nTrp(OMe)-DL-xiIle-DL-Pip] (CAS 183506-66-3), with molecular formula C33H47N5O6 and molecular weight 609.35 g/mol. IUPAC: 3-butan-2-yl-6-(1-methoxyindol-3-yl)-9-(6-oxooctyl)-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone.
Chemical Property Profile of 环[DL-Aoda-DL-nTrp(OMe)-DL-xiIle-DL-Pip]
Property Insights of 环[DL-Aoda-DL-nTrp(OMe)-DL-xiIle-DL-Pip]
The XLogP value of 4.1 indicates that 环[DL-Aoda-DL-nTrp(OMe)-DL-xiIle-DL-Pip] is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 环[DL-Aoda-DL-nTrp(OMe)-DL-xiIle-DL-Pip]. Following Lipinski's Rule of Five, 环[DL-Aoda-DL-nTrp(OMe)-DL-xiIle-DL-Pip] has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 环[DL-Aoda-DL-nTrp(OMe)-DL-xiIle-DL-Pip]?
The CAS number of 环[DL-Aoda-DL-nTrp(OMe)-DL-xiIle-DL-Pip] is 183506-66-3.
What is the molecular formula of 环[DL-Aoda-DL-nTrp(OMe)-DL-xiIle-DL-Pip]?
The molecular formula of 环[DL-Aoda-DL-nTrp(OMe)-DL-xiIle-DL-Pip] is C33H47N5O6.
What is the molecular weight of 环[DL-Aoda-DL-nTrp(OMe)-DL-xiIle-DL-Pip]?
The molecular weight of 环[DL-Aoda-DL-nTrp(OMe)-DL-xiIle-DL-Pip] is 609.35 g/mol.
Where can I buy 环[DL-Aoda-DL-nTrp(OMe)-DL-xiIle-DL-Pip]?
You can request a quote for 环[DL-Aoda-DL-nTrp(OMe)-DL-xiIle-DL-Pip] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 环[DL-Aoda-DL-nTrp(OMe)-DL-xiIle-DL-Pip]?
Yes, KEHONG BIO provides custom synthesis services for 环[DL-Aoda-DL-nTrp(OMe)-DL-xiIle-DL-Pip] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.