C6H15ClN2
TL;DR: C6H15ClN2 (CAS 25543-28-6) is a chemical compound with molecular formula C26H36O7 and molecular weight 460.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(11-hydroxy-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icos-17-en-8-yl)-2-oxoethyl] acetate
Also Known As: N-(2-Chloroethyl)-N-methyl-1,3-propanediamine, 1,3-Propanediamine, N-(2-chloroethyl)-N-methyl-, 2-(5-hydroxy-4a,6a,8,8-tetramethyl-2-oxo-2,3,4,4a,4b,5,6,6a,9a,10,10a,10b,11,12-tetradecahydro-6bh-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-6b-yl)-2-oxoethyl acetate, 2-(5-Hydroxy-4a,6a,8,8-tetramethyl-2-oxo-2,3,4,4a,4b,5,6,6a,9a,10,10a,10b,11,12-tetradecahydro-6bH,8H-naphtho[2',1':4,5]indeno[1,2-d][1,3]dioxol-6b-yl)-2-oxoethyl acetate
| Molecular Formula | C26H36O7 |
|---|---|
| Molecular Weight | 460.25 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 99.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 460.2461 |
| Heavy Atoms | 33 |
| Complexity | 937.0 |
Chemical Identifiers
| CAS Number | 25543-28-6 |
|---|---|
| SMILES | CC(=O)OCC(=O)C12C(CC3C1(CC(C4C3CCC5=CC(=O)CCC45C)O)C)OC(O2)(C)C |
| InChIKey | JJCMNPASNQSMEE-UHFFFAOYSA-N |
Product Overview
C6H15ClN2 (CAS 25543-28-6), with molecular formula C26H36O7 and molecular weight 460.25 g/mol. IUPAC: [2-(11-hydroxy-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icos-17-en-8-yl)-2-oxoethyl] acetate.
Chemical Property Profile of C6H15ClN2
Property Insights of C6H15ClN2
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C6H15ClN2. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for C6H15ClN2. Following Lipinski's Rule of Five, C6H15ClN2 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 C6H15ClN2?
The CAS number of C6H15ClN2 is 25543-28-6.
What is the molecular formula of C6H15ClN2?
The molecular formula of C6H15ClN2 is C26H36O7.
What is the molecular weight of C6H15ClN2?
The molecular weight of C6H15ClN2 is 460.25 g/mol.
Where can I buy C6H15ClN2?
You can request a quote for C6H15ClN2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C6H15ClN2?
Yes, KEHONG BIO provides custom synthesis services for C6H15ClN2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.