衣霉素
TL;DR: 衣霉素 (CAS 53342-16-8) is a chemical compound with molecular formula C28H38N4O6 and molecular weight 526.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
衣霉素
3-benzyl-6,6-dimethyl-9-[6-(oxiran-2-yl)-6-oxohexyl]-1,4,7,10-tetrazabicyclo[10.3.0]pentadecane-2,5,8,11-tetrone
Also Known As: chlamydocin, (3S,9S,12R)-3-benzyl-6,6-dimethyl-9-[6-[(2S)-oxiran-2-yl]-6-oxohexyl]-1,4,7,10-tetrazabicyclo[10.3.0]pentadecane-2,5,8,11-tetrone, 3-benzyl-6,6-dimethyl-9-[6-(oxiran-2-yl)-6-oxohexyl]-1,4,7,10-tetrazabicyclo[10.3.0]pentadecane-2,5,8,11-tetrone, 9-benzyl-6,6-dimethyl-3-[6-(oxiran-2-yl)-6-oxohexyl]decahydropyrrolo[1,2-a][1,4,7,10]tetraazacyclododecine-1,4,7,10-tetrone
| Molecular Formula | C28H38N4O6 |
|---|---|
| Molecular Weight | 526.28 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 137.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 526.2791 |
| Heavy Atoms | 38 |
| Complexity | 915.0 |
Chemical Identifiers
| CAS Number | 53342-16-8 |
|---|---|
| SMILES | CC1(C(=O)NC(C(=O)N2CCCC2C(=O)NC(C(=O)N1)CCCCCC(=O)C3CO3)CC4=CC=CC=C4)C |
| InChIKey | SGYJGGKDGBXCNY-UHFFFAOYSA-N |
Product Overview
衣霉素 (CAS 53342-16-8), with molecular formula C28H38N4O6 and molecular weight 526.28 g/mol. IUPAC: 3-benzyl-6,6-dimethyl-9-[6-(oxiran-2-yl)-6-oxohexyl]-1,4,7,10-tetrazabicyclo[10.3.0]pentadecane-2,5,8,11-tetrone.
Chemical Property Profile of 衣霉素
Property Insights of 衣霉素
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 衣霉素. The TPSA of 137.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 衣霉素. Following Lipinski's Rule of Five, 衣霉素 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 衣霉素?
The CAS number of 衣霉素 is 53342-16-8.
What is the molecular formula of 衣霉素?
The molecular formula of 衣霉素 is C28H38N4O6.
What is the molecular weight of 衣霉素?
The molecular weight of 衣霉素 is 526.28 g/mol.
Where can I buy 衣霉素?
You can request a quote for 衣霉素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 衣霉素?
Yes, KEHONG BIO provides custom synthesis services for 衣霉素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.