EINECS 257-428-8
TL;DR: EINECS 257-428-8 (CAS 51799-69-0) is a chemical compound with molecular formula C26H31BrN2Se2 and molecular weight 610.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2Z)-3-ethyl-2-[(E)-3-(3-ethyl-5,6-dimethyl-1,3-benzoselenazol-3-ium-2-yl)-2-methylprop-2-enylidene]-5,6-dimethyl-1,3-benzoselenazole bromide
Also Known As: EINECS 257-428-8, 3-Ethyl-2-(3-(3-ethyl-5,6-dimethyl-3H-benzoselenazol-2-ylidene)-2-methylprop-1-enyl)-5,6-dimethylbenzoselenazolium bromide, 3-ethyl-2-[3- -2-methylprop-1-enyl]-5,6-dimethylbenzoselenazoliumbromide, (2Z)-3-ethyl-2-[(E)-3-(3-ethyl-5,6-dimethyl-1,3-benzoselenazol-3-ium-2-yl)-2-methylprop-2-enylidene]-5,6-dimethyl-1,3-benzoselenazole bromide, 3-ethyl-2-[3-(3-ethyl-5,6-dimethyl-1,3-benzoselenazol-3-ium-2-yl)-2-methylprop-2-enylidene]-5,6-dimethyl-1,3-benzoselenazole,bromide
| Molecular Formula | C26H31BrN2Se2 |
|---|---|
| Molecular Weight | 610.00 g/mol |
| LogP | 1.55618 |
| Topological Polar Surface Area | 7.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 610.0001 |
| Heavy Atoms | 31 |
| Complexity | 1204.0728 |
Chemical Identifiers
| CAS Number | 51799-69-0 |
|---|---|
| SMILES | CCN\1C2=C(C=C(C(=C2)C)C)[Se]/C1=C\C(=C\C3=[N+](C4=C([Se]3)C=C(C(=C4)C)C)CC)\C.[Br-] |
Product Overview
EINECS 257-428-8 (CAS 51799-69-0), with molecular formula C26H31BrN2Se2 and molecular weight 610.00 g/mol. IUPAC: (2Z)-3-ethyl-2-[(E)-3-(3-ethyl-5,6-dimethyl-1,3-benzoselenazol-3-ium-2-yl)-2-methylprop-2-enylidene]-5,6-dimethyl-1,3-benzoselenazole bromide.
Chemical Property Profile of EINECS 257-428-8
Property Insights of EINECS 257-428-8
The XLogP value of 1.55618 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 257-428-8. With a topological polar surface area (TPSA) of 7.12 Ų, EINECS 257-428-8 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, EINECS 257-428-8 has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EINECS 257-428-8?
The CAS number of EINECS 257-428-8 is 51799-69-0.
What is the molecular formula of EINECS 257-428-8?
The molecular formula of EINECS 257-428-8 is C26H31BrN2Se2.
What is the molecular weight of EINECS 257-428-8?
The molecular weight of EINECS 257-428-8 is 610.00 g/mol.
Where can I buy EINECS 257-428-8?
You can request a quote for EINECS 257-428-8 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 257-428-8?
Yes, KEHONG BIO provides custom synthesis services for EINECS 257-428-8 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.